 Entering Gaussian System, Link 0=g16
 Input=27_methylindane_Boat_STD_M11-augccpVDZr.in
 Output=27_methylindane_Boat_STD_M11-augccpVDZr.log
 AtFile(1): /user/pierpa/basis_sets/augccpVDZ.gbs
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            ****
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            ****
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            ****
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            ****
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            ****
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            ****
            -Mn     0
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                  1.349768D+05          -8.570592D-06
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                  6.554800D-02           5.755741D-01
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            S    20   1.00
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                  5.931155D+05          -3.282099D-06
                  1.349768D+05          -1.667433D-05
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            S    1   1.00
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            ****
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                  5.188690D+01          -2.607900D-02
                  1.934190D+01          -1.082310D-01
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            ****
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                  8.715234D+05           6.647410D-05
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                  1.921470D-01           1.433224D-02
                  8.759500D-02          -6.671210D-03
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            S    20   1.00
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                  8.715234D+05           1.552973D-06
                  1.983350D+05           8.161259D-06
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                  8.759500D-02          -5.693429D-01
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                  8.715234D+05          -4.336894D-06
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            P    16   1.00
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                  1.876862D+03           1.440000D-04
                  7.182361D+02           6.450000D-04
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            P    16   1.00
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                  1.747518D+00           3.609760D-01
                  6.995600D-01           2.716570D-01
                  2.516080D-01           1.049810D-01
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                  6.144981D+01           2.617600D-02
                  2.305689D+01           1.113670D-01
                  9.577739D+00           3.045810D-01
                  4.133734D+00           3.862990D-01
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                  6.995600D-01          -5.388760D-01
                  2.516080D-01          -3.454730D-01
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                  1.461500D+00           7.546420D-01
            F    1   1.00
                  5.486100D-01           1.000000D+00
            ****
            -Ga     0
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                  7.271900D+04           1.604700D-03
                  1.655200D+04           8.340200D-03
                  4.687800D+03           3.402480D-02
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            S    14   1.00
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            S    14   1.00
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            D    1   1.00
                  0.0537000              1.0000000
            ****
            -Ge     0
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            ****
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            ****
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                  1.060579D+03           1.274240D-02
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                  1.289984D+02           2.085635D-01
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                  2.295942D+01           3.878103D-01
                  9.507300D+00           1.003820D-01
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                  1.750446D+00           2.713900D-03
                  5.291900D-01          -6.977000D-04
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            P    11   1.00
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                  1.060579D+03          -5.221200D-03
                  3.422081D+02          -2.684630D-02
                  1.289984D+02          -9.158230D-02
                  5.308722D+01          -1.968164D-01
                  2.295942D+01          -1.634750D-01
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                  4.083055D+00           5.981592D-01
                  1.750446D+00           2.750453D-01
                  5.291900D-01           1.277060D-02
                  1.643690D-01          -1.013500D-03
            P    11   1.00
                  4.474270D+03           1.701000D-04
                  1.060579D+03           1.406400D-03
                  3.422081D+02           7.396300D-03
                  1.289984D+02           2.482540D-02
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                  2.295942D+01           4.121320D-02
                  9.507300D+00          -8.760570D-02
                  4.083055D+00          -2.440586D-01
                  1.750446D+00          -2.950070D-02
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            P    1   1.00
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            D    5   1.00
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                  3.346525D+01           1.321620D-01
                  1.183046D+01           3.633484D-01
                  4.339771D+00           4.929582D-01
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            D    1   1.00
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            ****
            -Y     0
            S    7   1.00
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                 16.6827000             -0.0497340
                 10.4235000              0.1315590
                  3.0952600             -0.5243820
                  0.7079710              0.7863790
                  0.3225670              0.4639580
                  0.0690850              0.0204860
            S    7   1.00
                 29.2935000             -0.0013580
                 16.6827000              0.0123920
                 10.4235000             -0.0375720
                  3.0952600              0.1741090
                  0.7079710             -0.3385090
                  0.3225670             -0.3354170
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            S    7   1.00
                 29.2935000              0.0112420
                 16.6827000             -0.0574010
                 10.4235000              0.1106480
                  3.0952600             -0.3769430
                  0.7079710              1.2026360
                  0.3225670             -0.4875820
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            S    1   1.00
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            P    6   1.00
                  9.0271500              0.0203960
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                  0.4727970              0.4983480
                  0.2197340              0.1957420
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            P    6   1.00
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                  0.9906740             -0.1495270
                  0.4727970             -0.2243370
                  0.2197340             -0.0114700
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            P    6   1.00
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                  4.0242700             -0.0963010
                  0.9906740              0.2986850
                  0.4727970              0.8892190
                  0.2197340             -1.4854780
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            P    1   1.00
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            D    5   1.00
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                  0.5614050              0.2962740
                  0.2267020              0.3908730
                  0.0879490              0.3539610
            D    5   1.00
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                  1.3201900             -0.1499100
                  0.5614050             -0.3732930
                  0.2267020             -0.3129870
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            D    1   1.00
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            D    1   1.00
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            F    1   1.00
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            F    1   1.00
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            ****
            -Zr     0
            S    7   1.00
                 53.4460000              0.0014860
                 17.0981000             -0.0365920
                 10.6875000              0.1321550
                  3.3913400             -0.5464540
                  0.7884750              0.8022910
                  0.3599820              0.4583040
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            S    7   1.00
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                 17.0981000              0.0096310
                 10.6875000             -0.0390430
                  3.3913400              0.1847170
                  0.7884750             -0.3584690
                  0.3599820             -0.3208280
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            S    7   1.00
                 53.4460000              0.0028110
                 17.0981000             -0.0412920
                 10.6875000              0.1148910
                  3.3913400             -0.4348090
                  0.7884750              1.4174320
                  0.3599820             -0.7286190
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            S    1   1.00
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            S    1   1.00
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            P    6   1.00
                  9.9011600              0.0214360
                  4.4181900             -0.1604130
                  1.0931000              0.4543260
                  0.5187860              0.4991190
                  0.2363630              0.1777830
                  0.0847070              0.0104040
            P    6   1.00
                  9.9011600             -0.0058310
                  4.4181900              0.0481520
                  1.0931000             -0.1600800
                  0.5187860             -0.2201350
                  0.2363630              0.0355150
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            P    6   1.00
                  9.9011600             -0.0078290
                  4.4181900              0.0660080
                  1.0931000             -0.2113740
                  0.5187860             -0.3575490
                  0.2363630              0.1703870
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            P    1   1.00
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            P    1   1.00
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            D    5   1.00
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                  1.5708900              0.1278490
                  0.6923540              0.3219090
                  0.2904140              0.3998190
                  0.1158780              0.3194760
            D    5   1.00
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                  1.5708900             -0.1579890
                  0.6923540             -0.3979000
                  0.2904140             -0.2555990
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            D    1   1.00
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            D    1   1.00
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            F    1   1.00
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            F    1   1.00
                  0.0891000              1.0000000
            ****
            -Nb     0
            S    7   1.00
                 80.8096000              0.0008890
                 17.9220000             -0.0347930
                 11.2050000              0.1389100
                  3.6990100             -0.5655680
                  0.8712090              0.8147210
                  0.3974440              0.4547970
                  0.0854690              0.0200510
            S    7   1.00
                 80.8096000             -0.0002000
                 17.9220000              0.0093020
                 11.2050000             -0.0414910
                  3.6990100              0.1923710
                  0.8712090             -0.3713520
                  0.3974440             -0.3068350
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            S    7   1.00
                 80.8096000              0.0015640
                 17.9220000             -0.0382840
                 11.2050000              0.1209450
                  3.6990100             -0.4647790
                  0.8712090              1.5031600
                  0.3974440             -0.8262330
                  0.0854690             -1.5845850
            S    1   1.00
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            S    1   1.00
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            P    6   1.00
                 10.6457000              0.0234360
                  4.8235100             -0.1683110
                  1.2030900              0.4693810
                  0.5695080              0.4980520
                  0.2569700              0.1675400
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            P    6   1.00
                 10.6457000             -0.0064960
                  4.8235100              0.0513810
                  1.2030900             -0.1706080
                  0.5695080             -0.2198720
                  0.2569700              0.0561670
                  0.0929460              0.6165950
            P    6   1.00
                 10.6457000             -0.0091300
                  4.8235100              0.0732300
                  1.2030900             -0.2370360
                  0.5695080             -0.3685640
                  0.2569700              0.2364390
                  0.0929460              0.8267330
            P    1   1.00
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            P    1   1.00
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            D    5   1.00
                  4.5456300             -0.0104650
                  1.8272300              0.1305530
                  0.8257640              0.3347580
                  0.3551560              0.4020270
                  0.1447240              0.3008350
            D    5   1.00
                  4.5456300              0.0105280
                  1.8272300             -0.1615000
                  0.8257640             -0.4113720
                  0.3551560             -0.2117820
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            D    1   1.00
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            D    1   1.00
                  0.0204000              1.0000000
            F    1   1.00
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            F    1   1.00
                  0.1387000              1.0000000
            ****
            -Mo     0
            S    7   1.00
                106.9780000              0.0007350
                 18.8824000             -0.0350900
                 11.8077000              0.1473480
                  4.0211800             -0.5833630
                  0.9568160              0.8256350
                  0.4356920              0.4523110
                  0.0925180              0.0190550
            S    7   1.00
                106.9780000             -0.0001760
                 18.8824000              0.0093320
                 11.8077000             -0.0438110
                  4.0211800              0.1972320
                  0.9568160             -0.3773110
                  0.4356920             -0.2939670
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            S    7   1.00
                106.9780000              0.0011660
                 18.8824000             -0.0376070
                 11.8077000              0.1259800
                  4.0211800             -0.4752370
                  0.9568160              1.4989830
                  0.4356920             -0.8223450
                  0.0925180             -1.5606240
            S    1   1.00
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            S    1   1.00
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            P    6   1.00
                 11.4118000              0.0253450
                  5.2453500             -0.1752130
                  1.3188400              0.4812720
                  0.6229830              0.4972610
                  0.2791080              0.1595550
                  0.1005260              0.0075430
            P    6   1.00
                 11.4118000             -0.0070220
                  5.2453500              0.0533390
                  1.3188400             -0.1756430
                  0.6229830             -0.2162130
                  0.2791080              0.0679580
                  0.1005260              0.6128160
            P    6   1.00
                 11.4118000             -0.0104200
                  5.2453500              0.0798670
                  1.3188400             -0.2629000
                  0.6229830             -0.3651840
                  0.2791080              0.2866730
                  0.1005260              0.8002580
            P    1   1.00
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            P    1   1.00
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            D    5   1.00
                  5.2576100             -0.0147610
                  2.1046200              0.1319820
                  0.9582010              0.3470860
                  0.4140470              0.4054710
                  0.1684500              0.2880580
            D    5   1.00
                  5.2576100              0.0154390
                  2.1046200             -0.1606210
                  0.9582010             -0.4232290
                  0.4140470             -0.1923390
                  0.1684500              0.5314590
            D    1   1.00
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            D    1   1.00
                  0.0231000              1.0000000
            F    1   1.00
                  0.6007000              1.0000000
            F    1   1.00
                  0.1850000              1.0000000
            ****
            -Tc     0
            S    7   1.00
                132.6560000              0.0006860
                 19.8986000             -0.0360010
                 12.4450000              0.1564650
                  4.3605000             -0.5995730
                  1.0443600              0.8357100
                  0.4741590              0.4490550
                  0.0987360              0.0183780
            S    7   1.00
                132.6560000             -0.0001680
                 19.8986000              0.0093110
                 12.4450000             -0.0455350
                  4.3605000              0.1986020
                  1.0443600             -0.3749740
                  0.4741590             -0.2817600
                  0.0987360              0.6329980
            S    7   1.00
                132.6560000              0.0009800
                 19.8986000             -0.0378410
                 12.4450000              0.1317670
                  4.3605000             -0.4834180
                  1.0443600              1.4848540
                  0.4741590             -0.8047310
                  0.0987360             -1.5511910
            S    1   1.00
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            S    1   1.00
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            P    6   1.00
                 12.1789000              0.0273140
                  5.6848400             -0.1814030
                  1.4398300              0.4908910
                  0.6789090              0.4965410
                  0.3025150              0.1532990
                  0.1073070              0.0067000
            P    6   1.00
                 12.1789000             -0.0074300
                  5.6848400              0.0541370
                  1.4398300             -0.1762270
                  0.6789090             -0.2096540
                  0.3025150              0.0734980
                  0.1073070              0.6070490
            P    6   1.00
                 12.1789000             -0.0116300
                  5.6848400              0.0854050
                  1.4398300             -0.2844050
                  0.6789090             -0.3578760
                  0.3025150              0.3260330
                  0.1073070              0.7801240
            P    1   1.00
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            P    1   1.00
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            D    5   1.00
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                  2.3642400              0.1344070
                  1.0887100              0.3547260
                  0.4740600              0.4044790
                  0.1936070              0.2788770
            D    5   1.00
                  5.7601300              0.0169910
                  2.3642400             -0.1548960
                  1.0887100             -0.4281920
                  0.4740600             -0.1789920
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            D    1   1.00
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            D    1   1.00
                  0.0264000              1.0000000
            F    1   1.00
                  0.7228000              1.0000000
            F    1   1.00
                  0.2272000              1.0000000
            ****
            -Ru     0
            S    7   1.00
                159.3720000              0.0006730
                 20.9016000             -0.0371610
                 13.0741000              0.1665170
                  4.7147400             -0.6159540
                  1.1361200              0.8428300
                  0.5154640              0.4477630
                  0.1067670              0.0184450
            S    7   1.00
                159.3720000             -0.0001690
                 20.9016000              0.0093920
                 13.0741000             -0.0477130
                  4.7147400              0.2011130
                  1.1361200             -0.3734210
                  0.5154640             -0.2738590
                  0.1067670              0.6093840
            S    7   1.00
                159.3720000              0.0008950
                 20.9016000             -0.0396350
                 13.0741000              0.1442430
                  4.7147400             -0.5192870
                  1.1361200              1.5854040
                  0.5154640             -0.9082030
                  0.1067670             -1.4720020
            S    1   1.00
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            S    1   1.00
                  0.0144000              1.0000000
            P    6   1.00
                 12.8738000              0.0299680
                  6.1475000             -0.1879300
                  1.5652400              0.4999900
                  0.7361940              0.4957320
                  0.3263170              0.1475150
                  0.1124070              0.0060880
            P    6   1.00
                 12.8738000             -0.0078010
                  6.1475000              0.0536560
                  1.5652400             -0.1719400
                  0.7361940             -0.1991700
                  0.3263170              0.0744110
                  0.1124070              0.5971370
            P    6   1.00
                 12.8738000             -0.0135020
                  6.1475000              0.0937330
                  1.5652400             -0.3159100
                  0.7361940             -0.3618000
                  0.3263170              0.4008770
                  0.1124070              0.7537660
            P    1   1.00
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            P    1   1.00
                  0.0137000              1.0000000
            D    5   1.00
                  6.2126500             -0.0245970
                  2.7853900              0.1273340
                  1.2685100              0.3570810
                  0.5517900              0.4082070
                  0.2247310              0.2812400
            D    5   1.00
                  6.2126500              0.0261160
                  2.7853900             -0.1459400
                  1.2685100             -0.4425210
                  0.5517900             -0.1690200
                  0.2247310              0.5052370
            D    1   1.00
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            D    1   1.00
                  0.0302000              1.0000000
            F    1   1.00
                  0.8500000              1.0000000
            F    1   1.00
                  0.2719000              1.0000000
            ****
            -Rh     0
            S    7   1.00
                184.6660000              0.0006920
                 21.9974000             -0.0383930
                 13.7616000              0.1760190
                  5.0872000             -0.6299250
                  1.2294000              0.8495440
                  0.5568140              0.4457290
                  0.1140670              0.0182040
            S    7   1.00
                184.6660000             -0.0001780
                 21.9974000              0.0094560
                 13.7616000             -0.0494720
                  5.0872000              0.2018670
                  1.2294000             -0.3698090
                  0.5568140             -0.2653310
                  0.1140670              0.5891540
            S    7   1.00
                184.6660000              0.0008370
                 21.9974000             -0.0402860
                 13.7616000              0.1506490
                  5.0872000             -0.5268510
                  1.2294000              1.5723820
                  0.5568140             -0.8876430
                  0.1140670             -1.4709450
            S    1   1.00
                  0.0414150              1.0000000
            S    1   1.00
                  0.0150000              1.0000000
            P    6   1.00
                 13.6985000              0.0318210
                  6.6247600             -0.1930280
                  1.6961300              0.5062420
                  0.7973510              0.4949020
                  0.3520340              0.1440300
                  0.1233420              0.0056080
            P    6   1.00
                 13.6985000             -0.0085830
                  6.6247600              0.0568110
                  1.6961300             -0.1801720
                  0.7973510             -0.2034110
                  0.3520340              0.0848180
                  0.1233420              0.6010570
            P    6   1.00
                 13.6985000             -0.0151640
                  6.6247600              0.1011250
                  1.6961300             -0.3456410
                  0.7973510             -0.3454850
                  0.3520340              0.4221020
                  0.1233420              0.7304790
            P    1   1.00
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            P    1   1.00
                  0.0151000              1.0000000
            D    5   1.00
                 18.7370000              0.0064810
                 11.7046000             -0.0139420
                  2.2555800              0.2506820
                  0.9494110              0.4511110
                  0.3661640              0.3839990
            D    5   1.00
                 18.7370000             -0.0075900
                 11.7046000              0.0162940
                  2.2555800             -0.3347730
                  0.9494110             -0.4463960
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            D    1   1.00
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            D    1   1.00
                  0.0420000              1.0000000
            F    1   1.00
                  0.9936000              1.0000000
            F    1   1.00
                  0.3222000              1.0000000
            ****
            -Pd     0
            S    7   1.00
                208.1230000              0.0007270
                 22.8525000             -0.0409280
                 14.2986000              0.1922850
                  5.4880100             -0.6501040
                  1.3253200              0.8565530
                  0.5989570              0.4438760
                  0.1209830              0.0178500
            S    7   1.00
                208.1230000             -0.0001890
                 22.8525000              0.0098180
                 14.2986000             -0.0528760
                  5.4880100              0.2035110
                  1.3253200             -0.3639350
                  0.5989570             -0.2582190
                  0.1209830              0.5704320
            S    7   1.00
                208.1230000              0.0008000
                 22.8525000             -0.0417810
                 14.2986000              0.1593620
                  5.4880100             -0.5231230
                  1.3253200              1.4917730
                  0.5989570             -0.7916960
                  0.1209830             -1.5172540
            S    1   1.00
                  0.0434590              1.0000000
            S    1   1.00
                  0.0156000              1.0000000
            P    6   1.00
                 14.0509000              0.0379970
                  7.1390600             -0.2040770
                  1.8300700              0.5137680
                  0.8583350              0.4942400
                  0.3772750              0.1402910
                  0.1256960              0.0051570
            P    6   1.00
                 14.0509000             -0.0093130
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                  0.4340380             -0.3195670
                  0.1050310              0.6651050
            S    7   1.00
                 29.8670000              0.0324720
                 18.7203000             -0.1723550
                 11.7533000              0.3341840
                  4.5708900             -0.5725580
                  0.9478400              1.3652610
                  0.4340380             -0.6032250
                  0.1050310             -1.7315730
            S    1   1.00
                  0.0389480              1.0000000
            S    1   1.00
                  0.0144000              1.0000000
            P    6   1.00
                  7.3652400              0.1796820
                  4.7544000             -0.5211000
                  2.9959500              0.1911040
                  0.9941230              0.6464550
                  0.4196000              0.4240400
                  0.1182390              0.0425600
            P    6   1.00
                  7.3652400             -0.0508780
                  4.7544000              0.1495500
                  2.9959500             -0.0507540
                  0.9941230             -0.2483790
                  0.4196000             -0.1478010
                  0.1182390              0.5415390
            P    6   1.00
                  7.3652400             -0.0697670
                  4.7544000              0.2016550
                  2.9959500             -0.0482900
                  0.9941230             -0.4247200
                  0.4196000             -0.1275720
                  0.1182390              0.9415430
            P    1   1.00
                  0.0401010              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  7.5616000              0.0178690
                  4.7408700             -0.0661360
                  1.1697500              0.2554580
                  0.4793100              0.4454920
                  0.1837040              0.4029670
            D    5   1.00
                  7.5616000             -0.0205840
                  4.7408700              0.0780240
                  1.1697500             -0.3544000
                  0.4793100             -0.5155940
                  0.1837040              0.4207610
            D    1   1.00
                  0.0644090              1.0000000
            D    1   1.00
                  0.0226000              1.0000000
            F    1   1.00
                  0.3735000              1.0000000
            F    1   1.00
                  0.1286000              1.0000000
            ****
            -W     0
            S    7   1.00
                 31.1844000              0.0268990
                 19.5385000             -0.1892380
                 12.2602000              0.4339650
                  4.7203700             -0.8043720
                  1.0095700              0.9015400
                  0.4634560              0.4101950
                  0.1137920              0.0110440
            S    7   1.00
                 31.1844000             -0.0086330
                 19.5385000              0.0609770
                 12.2602000             -0.1418640
                  4.7203700              0.2797320
                  1.0095700             -0.4285050
                  0.4634560             -0.3050150
                  0.1137920              0.6713040
            S    7   1.00
                 31.1844000              0.0314780
                 19.5385000             -0.1676990
                 12.2602000              0.3282920
                  4.7203700             -0.5865250
                  1.0095700              1.4154490
                  0.4634560             -0.6488270
                  0.1137920             -1.6892530
            S    1   1.00
                  0.0416420              1.0000000
            S    1   1.00
                  0.0152000              1.0000000
            P    6   1.00
                  7.7873800              0.1852090
                  5.0493000             -0.5283120
                  3.1860200              0.1871580
                  1.0593700              0.6560130
                  0.4491060              0.4179250
                  0.1276250              0.0409650
            P    6   1.00
                  7.7873800             -0.0535080
                  5.0493000              0.1546790
                  3.1860200             -0.0504270
                  1.0593700             -0.2604500
                  0.4491060             -0.1384050
                  0.1276250              0.5459010
            P    6   1.00
                  7.7873800             -0.0749390
                  5.0493000              0.2120220
                  3.1860200             -0.0424460
                  1.0593700             -0.4793750
                  0.4491060             -0.0766750
                  0.1276250              0.9477960
            P    1   1.00
                  0.0427440              1.0000000
            P    1   1.00
                  0.0143000              1.0000000
            D    5   1.00
                  8.3098300              0.0219490
                  5.2246300             -0.0773760
                  1.2952900              0.2632410
                  0.5397610              0.4595460
                  0.2089270              0.3922120
            D    5   1.00
                  8.3098300             -0.0263810
                  5.2246300              0.0952520
                  1.2952900             -0.3960520
                  0.5397610             -0.5079960
                  0.2089270              0.5236000
            D    1   1.00
                  0.0731130              1.0000000
            D    1   1.00
                  0.0256000              1.0000000
            F    1   1.00
                  0.4769000              1.0000000
            F    1   1.00
                  0.1768000              1.0000000
            ****
            -Re     0
            S    7   1.00
                 33.0133000              0.0221330
                 20.6658000             -0.1618310
                 12.9498000              0.3812300
                  4.7782300             -0.7875220
                  1.0858000              0.8980810
                  0.5000250              0.4224690
                  0.1210690              0.0172060
            S    7   1.00
                 33.0133000             -0.0070680
                 20.6658000              0.0530520
                 12.9498000             -0.1282310
                  4.7782300              0.2853960
                  1.0858000             -0.4487810
                  0.5000250             -0.2976680
                  0.1210690              0.6634730
            S    7   1.00
                 33.0133000              0.0274240
                 20.6658000             -0.1468310
                 12.9498000              0.2908580
                  4.7782300             -0.5801000
                  1.0858000              1.4204980
                  0.5000250             -0.6321790
                  0.1210690             -1.6875030
            S    1   1.00
                  0.0438810              1.0000000
            S    1   1.00
                  0.0159000              1.0000000
            P    6   1.00
                  8.6759800              0.1394900
                  5.6538200             -0.3569770
                  1.4063900              0.4818040
                  0.6920560              0.5117960
                  0.3163520              0.1708180
                  0.1093090              0.0097820
            P    6   1.00
                  8.6759800             -0.0412390
                  5.6538200              0.1083450
                  1.4063900             -0.1688840
                  0.6920560             -0.2386860
                  0.3163520              0.0632430
                  0.1093090              0.6102210
            P    6   1.00
                  8.6759800             -0.0651350
                  5.6538200              0.1725300
                  1.4063900             -0.2649320
                  0.6920560             -0.4743410
                  0.3163520              0.3991830
                  0.1093090              0.8030920
            P    1   1.00
                  0.0385810              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  8.6719700              0.0171910
                  5.4414200             -0.0665390
                  1.3750800              0.2711570
                  0.5838300              0.4487710
                  0.2293620              0.3778590
            D    5   1.00
                  8.6719700             -0.0203340
                  5.4414200              0.0775390
                  1.3750800             -0.3686920
                  0.5838300             -0.4745880
                  0.2293620              0.4599950
            D    1   1.00
                  0.0808850              1.0000000
            D    1   1.00
                  0.0285000              1.0000000
            F    1   1.00
                  0.5533000              1.0000000
            F    1   1.00
                  0.2126000              1.0000000
            ****
            -Os     0
            S    7   1.00
                 34.5933000              0.0194050
                 21.6442000             -0.1468750
                 13.5521000              0.3551890
                  4.8950800             -0.7883690
                  1.1634600              0.9033000
                  0.5380840              0.4302560
                  0.1306730              0.0181640
            S    7   1.00
                 34.5933000             -0.0059240
                 21.6442000              0.0475810
                 13.5521000             -0.1198590
                  4.8950800              0.2905900
                  1.1634600             -0.4633260
                  0.5380840             -0.2910580
                  0.1306730              0.6489970
            S    7   1.00
                 34.5933000              0.0286790
                 21.6442000             -0.1533520
                 13.5521000              0.3066570
                  4.8950800             -0.6590400
                  1.1634600              1.6880660
                  0.5380840             -0.9098660
                  0.1306730             -1.5178370
            S    1   1.00
                  0.0469820              1.0000000
            S    1   1.00
                  0.0169000              1.0000000
            P    6   1.00
                  9.1259400              0.1316100
                  5.8907300             -0.3487910
                  1.4397800              0.5276330
                  0.6929760              0.5000040
                  0.3084380              0.1387070
                  0.1086800              0.0055910
            P    6   1.00
                  9.1259400             -0.0379630
                  5.8907300              0.1036120
                  1.4397800             -0.1857190
                  0.6929760             -0.2213770
                  0.3084380              0.0960590
                  0.1086800              0.6029380
            P    6   1.00
                  9.1259400             -0.0676070
                  5.8907300              0.1858450
                  1.4397800             -0.3480470
                  0.6929760             -0.4511480
                  0.3084380              0.5586130
                  0.1086800              0.7068530
            P    1   1.00
                  0.0381830              1.0000000
            P    1   1.00
                  0.0134000              1.0000000
            D    5   1.00
                  9.3395000              0.0158420
                  5.8557100             -0.0635100
                  1.4647600              0.2828700
                  0.6312200              0.4507810
                  0.2506620              0.3664550
            D    5   1.00
                  9.3395000             -0.0209240
                  5.8557100              0.0807150
                  1.4647600             -0.4242800
                  0.6312200             -0.4620180
                  0.2506620              0.5555660
            D    1   1.00
                  0.0891640              1.0000000
            D    1   1.00
                  0.0317000              1.0000000
            F    1   1.00
                  0.6278000              1.0000000
            F    1   1.00
                  0.2478000              1.0000000
            ****
            -Ir     0
            S    7   1.00
                 36.0577000              0.0172890
                 22.5516000             -0.1359910
                 14.1116000              0.3386690
                  5.0447500             -0.7941690
                  1.2441700              0.9080010
                  0.5769240              0.4378070
                  0.1394660              0.0187690
            S    7   1.00
                 36.0577000             -0.0049480
                 22.5516000              0.0431240
                 14.1116000             -0.1138030
                  5.0447500              0.2953180
                  1.2441700             -0.4732180
                  0.5769240             -0.2840000
                  0.1394660              0.6351880
            S    7   1.00
                 36.0577000              0.0290550
                 22.5516000             -0.1546790
                 14.1116000              0.3116730
                  5.0447500             -0.7039290
                  1.2441700              1.8161160
                  0.5769240             -1.0291110
                  0.1394660             -1.4393180
            S    1   1.00
                  0.0497400              1.0000000
            S    1   1.00
                  0.0177000              1.0000000
            P    6   1.00
                  9.5858000              0.1256510
                  6.1408800             -0.3433060
                  1.4976000              0.5536780
                  0.7141440              0.4910420
                  0.3120660              0.1228370
                  0.1151600              0.0033780
            P    6   1.00
                  9.5858000             -0.0379390
                  6.1408800              0.1069870
                  1.4976000             -0.2083670
                  0.7141440             -0.2217720
                  0.3120660              0.1266520
                  0.1151600              0.6103680
            P    6   1.00
                  9.5858000             -0.0740030
                  6.1408800              0.2101790
                  1.4976000             -0.4612670
                  0.7141440             -0.3768670
                  0.3120660              0.6521120
                  0.1151600              0.6073860
            P    1   1.00
                  0.0412770              1.0000000
            P    1   1.00
                  0.0148000              1.0000000
            D    5   1.00
                  9.9606900              0.0154630
                  6.2430300             -0.0631200
                  1.5631700              0.2923090
                  0.6819400              0.4527480
                  0.2734460              0.3571590
            D    5   1.00
                  9.9606900             -0.0198010
                  6.2430300              0.0777020
                  1.5631700             -0.4252400
                  0.6819400             -0.4331870
                  0.2734460              0.4752470
            D    1   1.00
                  0.0980080              1.0000000
            D    1   1.00
                  0.0351000              1.0000000
            F    1   1.00
                  0.7127000              1.0000000
            F    1   1.00
                  0.2898000              1.0000000
            ****
            -Pt     0
            S    7   1.00
                 37.3750000              0.0156980
                 23.3685000             -0.1285150
                 14.6164000              0.3299960
                  5.2209620             -0.8039770
                  1.3267320              0.9127650
                  0.6163210              0.4444260
                  0.1480680              0.0192250
            S    7   1.00
                 37.3750000             -0.0041400
                 23.3685000              0.0396870
                 14.6164000             -0.1100630
                  5.2209620              0.3003960
                  1.3267320             -0.4809750
                  0.6163210             -0.2769970
                  0.1480680              0.6216130
            S    7   1.00
                 37.3750000              0.0303040
                 23.3685000             -0.1595530
                 14.6164000              0.3222870
                  5.2209620             -0.7469090
                  1.3267320              1.9183060
                  0.6163210             -1.1164460
                  0.1480680             -1.3836520
            S    1   1.00
                  0.0523910              1.0000000
            S    1   1.00
                  0.0185000              1.0000000
            P    6   1.00
                  9.9926800              0.1240460
                  6.3831700             -0.3446320
                  1.5696500              0.5711200
                  0.7427790              0.4873560
                  0.3180200              0.1119590
                  0.1141460              0.0019280
            P    6   1.00
                  9.9926800             -0.0346870
                  6.3831700              0.0999320
                  1.5696500             -0.2018840
                  0.7427790             -0.1984590
                  0.3180200              0.1230340
                  0.1141460              0.5955770
            P    6   1.00
                  9.9926800             -0.0771530
                  6.3831700              0.2234940
                  1.5696500             -0.5228040
                  0.7427790             -0.3298980
                  0.3180200              0.7297730
                  0.1141460              0.5372880
            P    1   1.00
                  0.0398630              1.0000000
            P    1   1.00
                  0.0139000              1.0000000
            D    5   1.00
                 10.4126000              0.0150800
                  6.5226600             -0.0622950
                  1.6643000              0.3006490
                  0.7342080              0.4539610
                  0.2974070              0.3490010
            D    5   1.00
                 10.4126000             -0.0198660
                  6.5226600              0.0796630
                  1.6643000             -0.4687940
                  0.7342080             -0.4051740
                  0.2974070              0.5192890
            D    1   1.00
                  0.1075990              1.0000000
            D    1   1.00
                  0.0389000              1.0000000
            F    1   1.00
                  0.8018000              1.0000000
            F    1   1.00
                  0.3357000              1.0000000
            ****
            -Au     0
            S    8   1.00
                 38.0008000              0.0200090
                 23.9725000             -0.1516790
                 15.2182000              0.3639600
                  5.5399900             -0.8213260
                  1.3855100              0.9366410
                  0.6424610              0.4235270
                  0.1564960              0.0162500
                  0.0549100             -0.0009780
            S    8   1.00
                 38.0008000             -0.0053040
                 23.9725000              0.0463180
                 15.2182000             -0.1199400
                  5.5399900              0.3040620
                  1.3855100             -0.4945010
                  0.6424610             -0.2555160
                  0.1564960              0.6091630
                  0.0549100              0.5977670
            S    8   1.00
                 38.0008000              0.0323400
                 23.9725000             -0.1717620
                 15.2182000              0.3395030
                  5.5399900             -0.7461790
                  1.3855100              1.9174980
                  0.6424610             -1.1299310
                  0.1564960             -1.3662840
                  0.0549100              1.4423910
            S    1   1.00
                  0.0549100              1.0000000
            S    1   1.00
                  0.0193000              1.0000000
            P    7   1.00
                 10.3092000              0.1282170
                  6.6276500             -0.3537900
                  1.6744700              0.5662110
                  0.8011160              0.4931710
                  0.3468790              0.1137750
                  0.1227010              0.0025340
                  0.0424280              0.0006790
            P    7   1.00
                 10.3092000             -0.0358850
                  6.6276500              0.1028900
                  1.6744700             -0.2009880
                  0.8011160             -0.2010450
                  0.3468790              0.1165490
                  0.1227010              0.5949690
                  0.0424280              0.4555200
            P    7   1.00
                 10.3092000             -0.0772420
                  6.6276500              0.2226110
                  1.6744700             -0.4953530
                  0.8011160             -0.3607470
                  0.3468790              0.7100000
                  0.1227010              0.5688390
                  0.0424280              0.0011930
            P    1   1.00
                  0.0424280              1.0000000
            P    1   1.00
                  0.0147000              1.0000000
            D    6   1.00
                 11.0027000              0.0164670
                  6.8916600             -0.0680130
                  1.8080800              0.2994920
                  0.8210510              0.4543030
                  0.3441610              0.3442240
                  0.1297430              0.1212560
            D    6   1.00
                 11.0027000             -0.0236280
                  6.8916600              0.0956720
                  1.8080800             -0.5412940
                  0.8210510             -0.3955330
                  0.3441610              0.6191650
                  0.1297430              0.4682760
            D    1   1.00
                  0.1297430              1.0000000
            D    1   1.00
                  0.0489000              1.0000000
            F    1   1.00
                  0.8919000              1.0000000
            F    1   1.00
                  0.3789000              1.0000000
            ****
            -Hg     0
            S    8   1.00
                 41.4804000              0.0100720
                 22.5328000             -0.1147810
                 14.0790000              0.3564080
                  5.7247400             -0.8484430
                  1.4794800              0.9405960
                  0.6882660              0.4353290
                  0.1641810              0.0131780
                  0.0572230             -0.0023140
            S    8   1.00
                 41.4804000              0.0020320
                 22.5328000             -0.0323140
                 14.0790000              0.1153500
                  5.7247400             -0.3177630
                  1.4794800              0.5135230
                  0.6882660              0.2500500
                  0.1641810             -0.6488410
                  0.0572230             -0.5599430
            S    8   1.00
                 41.4804000              0.0218280
                 22.5328000             -0.1555640
                 14.0790000              0.3860250
                  5.7247400             -0.8961040
                  1.4794800              2.3321950
                  0.6882660             -1.5976600
                  0.1641810             -1.0536460
                  0.0572230              1.2895360
            S    1   1.00
                  0.0572230              1.0000000
            S    1   1.00
                  0.0199000              1.0000000
            P    7   1.00
                 10.5805000              0.1286920
                  6.8053900             -0.3608420
                  1.7901600              0.5641170
                  0.8622610              0.5002740
                  0.3752770              0.1137850
                  0.1284210              0.0029390
                  0.0434470              0.0004880
            P    7   1.00
                 10.5805000             -0.0344430
                  6.8053900              0.1009290
                  1.7901600             -0.1924390
                  0.8622610             -0.1960690
                  0.3752770              0.1042040
                  0.1284210              0.5873870
                  0.0434470              0.4727830
            P    7   1.00
                 10.5805000              0.0714680
                  6.8053900             -0.2108590
                  1.7901600              0.4452040
                  0.8622610              0.3916080
                  0.3752770             -0.6670830
                  0.1284210             -0.6195740
                  0.0434470             -0.0009090
            P    1   1.00
                  0.0434470              1.0000000
            P    1   1.00
                  0.0147000              1.0000000
            D    6   1.00
                 11.5841000              0.0167290
                  7.2487900             -0.0695580
                  1.9366200              0.3034370
                  0.8987480              0.4548780
                  0.3869310              0.3368080
                  0.1504660              0.1130160
            D    6   1.00
                 11.5841000             -0.0249840
                  7.2487900              0.1041030
                  1.9366200             -0.6169860
                  0.8987480             -0.3538260
                  0.3869310              0.6872800
                  0.1504660              0.3930900
            D    1   1.00
                  0.1504660              1.0000000
            D    1   1.00
                  0.0585000              1.0000000
            F    1   1.00
                  0.9974000              1.0000000
            F    1   1.00
                  0.4377000              1.0000000
            ****
            -Tl     0
            S    8   1.00
                 36.1096000              0.0229790
                 22.5732000             -0.1728970
                 14.1144000              0.4807030
                  6.1597600             -0.9532140
                  1.5706900              0.9608670
                  0.7459610              0.4319720
                  0.1958840              0.0131990
                  0.0710030             -0.0021060
            S    8   1.00
                 36.1096000              0.0059010
                 22.5732000             -0.0544410
                 14.1144000              0.1709120
                  6.1597600             -0.3868060
                  1.5706900              0.5717530
                  0.7459610              0.2895580
                  0.1958840             -0.7163850
                  0.0710030             -0.5289600
            S    1   1.00
                  0.1958840              1.0000000
            S    1   1.00
                  0.0710030              1.0000000
            S    1   1.00
                  0.0206000              1.0000000
            P    6   1.00
                 10.3856000              0.1621170
                  7.0093900             -0.4046950
                  1.7768800              0.6949780
                  0.7479420              0.4664960
                  0.1768080              0.0280130
                  0.0515320             -0.0041730
            P    6   1.00
                 10.3856000             -0.0391990
                  7.0093900              0.1017260
                  1.7768800             -0.2199420
                  0.7479420             -0.1194500
                  0.1768080              0.4597680
                  0.0515320              0.6763890
            P    1   1.00
                  0.0515320              1.0000000
            P    1   1.00
                  0.0130000              1.0000000
            D    6   1.00
                 10.9087000              0.0217120
                  6.8364900             -0.0832690
                  1.9974900              0.3418070
                  0.9144720              0.4833160
                  0.3895180              0.3047550
                  0.1501000              0.0649830
            D    1   1.00
                  0.1501000              1.0000000
            D    1   1.00
                  0.0437000              1.0000000
            ****
            -Pb     0
            S    8   1.00
                 37.4583000              0.0248240
                 23.3170000             -0.1810620
                 14.5759000              0.5007060
                  6.4337600             -0.9797370
                  1.6671900              0.9666300
                  0.8077320              0.4364870
                  0.2270840              0.0136860
                  0.0842520             -0.0020210
            S    8   1.00
                 37.4583000              0.0067850
                 23.3170000             -0.0601870
                 14.5759000              0.1889710
                  6.4337600             -0.4248380
                  1.6671900              0.6220350
                  0.8077320              0.3160880
                  0.2270840             -0.7594740
                  0.0842520             -0.5151310
            S    1   1.00
                  0.2270840              1.0000000
            S    1   1.00
                  0.0842520              1.0000000
            S    1   1.00
                  0.0278000              1.0000000
            P    6   1.00
                 10.6186000              0.1701740
                  7.1878100             -0.4241790
                  1.8943900              0.6934430
                  0.8167090              0.4737730
                  0.2036880              0.0290470
                  0.0649730             -0.0043860
            P    6   1.00
                 10.6186000             -0.0479540
                  7.1878100              0.1245560
                  1.8943900             -0.2597760
                  0.8167090             -0.1414800
                  0.2036880              0.5317690
                  0.0649730              0.6087590
            P    1   1.00
                  0.0649730              1.0000000
            P    1   1.00
                  0.0197000              1.0000000
            D    6   1.00
                 13.7266000              0.0107870
                  6.9898300             -0.0666500
                  2.1735200              0.3342590
                  1.0281200              0.4826840
                  0.4558570              0.3004140
                  0.1822000              0.0632580
            D    1   1.00
                  0.1822000              1.0000000
            D    1   1.00
                  0.0609000              1.0000000
            ****
            -Bi     0
            S    8   1.00
                211.8210000              0.0010880
                 21.3262000             -0.1058620
                 13.3654000              0.5308080
                  6.9461000             -1.0502650
                  1.7122900              0.9958560
                  0.8391070              0.3989520
                  0.2553640              0.0117780
                  0.0967000             -0.0014700
            S    8   1.00
                211.8210000              0.0004220
                 21.3262000             -0.0385370
                 13.3654000              0.2172380
                  6.9461000             -0.4810970
                  1.7122900              0.7015950
                  0.8391070              0.2905200
                  0.2553640             -0.7997780
                  0.0967000             -0.4961310
            S    1   1.00
                  0.2553640              1.0000000
            S    1   1.00
                  0.0967000              1.0000000
            S    1   1.00
                  0.0317000              1.0000000
            P    6   1.00
                 11.0644000              0.1672490
                  7.4500000             -0.4252620
                  2.0106900              0.6925250
                  0.8883210              0.4753740
                  0.2363690              0.0298590
                  0.0792900             -0.0044930
            P    6   1.00
                 11.0644000             -0.0522010
                  7.4500000              0.1390830
                  2.0106900             -0.2935560
                  0.8883210             -0.1585740
                  0.2363690              0.5743620
                  0.0792900              0.5726780
            P    1   1.00
                  0.0792900              1.0000000
            P    1   1.00
                  0.0254000              1.0000000
            D    6   1.00
                 16.2461000              0.0078080
                  6.9836300             -0.0668310
                  2.3747600              0.3241400
                  1.1537200              0.4858310
                  0.5259740              0.3010560
                  0.2151000              0.0631960
            D    1   1.00
                  0.2151000              1.0000000
            D    1   1.00
                  0.0745000              1.0000000
            ****
            -Po     0
            S    8   1.00
                295.3900000              0.0013830
                 21.2683000             -0.1050610
                 13.3379000              0.5914250
                  7.3652100             -1.1156970
                  1.7892000              1.0191620
                  0.8849940              0.3798790
                  0.2857870              0.0107810
                  0.1093240             -0.0011440
            S    8   1.00
                295.3900000              0.0006830
                 21.2683000             -0.0385730
                 13.3379000              0.2519580
                  7.3652100             -0.5330160
                  1.7892000              0.7669010
                  0.8849940              0.2818780
                  0.2857870             -0.8394770
                  0.1093240             -0.4792720
            S    1   1.00
                  0.2857870              1.0000000
            S    1   1.00
                  0.1093240              1.0000000
            S    1   1.00
                  0.0359000              1.0000000
            P    6   1.00
                 11.5069000              0.1663640
                  7.7299100             -0.4272350
                  2.1189400              0.6969640
                  0.9553230              0.4713590
                  0.2683520              0.0299870
                  0.0884940             -0.0034870
            P    6   1.00
                 11.5069000             -0.0559100
                  7.7299100              0.1511230
                  2.1189400             -0.3261600
                  0.9553230             -0.1614090
                  0.2683520              0.6016150
                  0.0884940              0.5559720
            P    1   1.00
                  0.0884940              1.0000000
            P    1   1.00
                  0.0278000              1.0000000
            D    6   1.00
                 18.7130000              0.0066940
                  7.0570800             -0.0671040
                  2.5506200              0.3257980
                  1.2506900              0.4957630
                  0.5742560              0.2931060
                  0.2330000              0.0541620
            D    1   1.00
                  0.2330000              1.0000000
            D    1   1.00
                  0.0895000              1.0000000
            ****
            -At     0
            S    8   1.00
                304.0310000              0.0010310
                 22.4085000             -0.1018690
                 14.0490000              0.5632730
                  7.5895000             -1.1045120
                  1.8949400              1.0263640
                  0.9523580              0.3833240
                  0.3170410              0.0113590
                  0.1224900             -0.0011400
            S    8   1.00
                304.0310000              0.0004960
                 22.4085000             -0.0387430
                 14.0490000              0.2490070
                  7.5895000             -0.5516910
                  1.8949400              0.8155580
                  0.9523580              0.2868020
                  0.3170410             -0.8682780
                  0.1224900             -0.4694960
            S    1   1.00
                  0.3170410              1.0000000
            S    1   1.00
                  0.1224900              1.0000000
            S    1   1.00
                  0.0404000              1.0000000
            P    6   1.00
                 12.0093000              0.1631810
                  8.0330000             -0.4244130
                  2.2239300              0.7031340
                  1.0213300              0.4641680
                  0.3012660              0.0302600
                  0.0999030             -0.0026180
            P    6   1.00
                 12.0093000             -0.0583630
                  8.0330000              0.1606310
                  2.2239300             -0.3589420
                  1.0213300             -0.1621230
                  0.3012660              0.6248880
                  0.0999030              0.5397840
            P    1   1.00
                  0.0999030              1.0000000
            P    1   1.00
                  0.0313000              1.0000000
            D    6   1.00
                 21.3084000              0.0061410
                  7.0207600             -0.0706690
                  2.7689800              0.3190200
                  1.3731400              0.5044700
                  0.6368040              0.2924810
                  0.2593000              0.0514950
            D    1   1.00
                  0.2593000              1.0000000
            D    1   1.00
                  0.1073000              1.0000000
            ****
            -Rn     0
            S    8   1.00
                383.5850000              0.0015720
                 23.2936000             -0.0761810
                 14.6096000              0.4785080
                  7.7319900             -1.0439020
                  1.9942400              1.0190710
                  1.0240700              0.3914520
                  0.3454220              0.0127820
                  0.1350810             -0.0012970
            S    8   1.00
                383.5850000              0.0009020
                 23.2936000             -0.0265350
                 14.6096000              0.2148510
                  7.7319900             -0.5453780
                  1.9942400              0.8694020
                  1.0240700              0.2728620
                  0.3454220             -0.8929670
                  0.1350810             -0.4539150
            S    1   1.00
                  0.3454220              1.0000000
            S    1   1.00
                  0.1350810              1.0000000
            S    1   1.00
                  0.0449000              1.0000000
            P    6   1.00
                 12.4992000              0.1629940
                  8.3397600             -0.4262290
                  2.3359100              0.7107760
                  1.0901900              0.4580860
                  0.3348980              0.0292130
                  0.1125460             -0.0031070
            P    6   1.00
                 12.4992000             -0.0609340
                  8.3397600              0.1694830
                  2.3359100             -0.3880550
                  1.0901900             -0.1612760
                  0.3348980              0.6446740
                  0.1125460              0.5255260
            P    1   1.00
                  0.1125460              1.0000000
            P    1   1.00
                  0.0348000              1.0000000
            D    6   1.00
                 24.1705000              0.0058780
                  6.9459900             -0.0765200
                  3.0380900              0.3071660
                  1.5168400              0.5141680
                  0.7091570              0.2972850
                  0.2888000              0.0512000
            D    1   1.00
                  0.2888000              1.0000000
            D    1   1.00
                  0.1251000              1.0000000
            ****
            
            -Y     0
            Y-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      7.85827500           135.13497400
            2      3.38212800            15.41163200
            p-g potential
              4
            2      6.84979100            29.25143700
            2      6.71009200            58.50836300
            2      3.04215900             3.78024300
            2      2.93733000             7.67654700
            d-g potential
              4
            2      5.41631500            11.84991100
            2      5.33341600            17.77810300
            2      1.97621200             2.06238300
            2      1.96111100             3.07565000
            f-g potential
              2
            2      5.02859000            -6.92807800
            2      5.00558200            -9.15509900
            -ZR     0
            ZR-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      8.63652800           150.24299400
            2      3.71763900            18.78003600
            p-g potential
              4
            2      7.62672800            33.19279100
            2      7.45320700            66.38903900
            2      3.35838900             4.62072600
            2      3.22973800             9.26027000
            d-g potential
              4
            2      5.93808600            13.99338300
            2      5.82554400            20.99588200
            2      2.20501900             2.28516600
            2      2.20629200             3.44126000
            f-g potential
              2
            2      4.80021500            -5.23932000
            2      4.79899200            -6.98742400
            -NB     0
            NB-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      9.37657800           165.15673600
            2      4.04357200            21.82395100
            p-g potential
              4
            2      8.36360900            37.24928400
            2      8.16689800            74.50738900
            2      3.69307500             5.43948600
            2      3.55104700            10.91325200
            d-g potential
              4
            2      6.68910800            15.21454900
            2      6.53719300            22.83350800
            2      2.55111800             3.00005200
            2      2.56789600             4.55373400
            f-g potential
              2
            2      5.56828500            -6.28135400
            2      5.67137200            -8.75564400
            -MO     0
            MO-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     10.09700000           180.07685300
            2      4.37567000            24.71592000
            p-g potential
              4
            2      9.12656400            41.22767800
            2      8.86322300            82.45267000
            2      4.04494800             6.34509200
            2      3.86665700            12.45842300
            d-g potential
              4
            2      7.53575400            19.30874400
            2      7.27897600            28.97767400
            2      2.76320500             3.18951600
            2      2.77208500             4.70016900
            f-g potential
              2
            2      6.30663300            -7.17888800
            2      6.35644800            -9.74597800
            -TC     0
            TC-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     10.79936900           195.09130300
            2      4.70725700            27.34041300
            p-g potential
              4
            2      9.82669900            45.06081200
            2      9.56111500            90.11729500
            2      4.37857800             7.07051700
            2      4.19090700            14.04801900
            d-g potential
              4
            2      8.33604500            21.65775500
            2      8.24453300            32.47195900
            2      3.09370700             3.78952500
            2      3.16872200             6.05343000
            f-g potential
              2
            2      7.04094000            -7.99562300
            2      7.06947300           -10.74569600
            -RU     0
            RU-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     11.50059000           209.78649300
            2      5.06857500            30.21430700
            p-g potential
              4
            2     10.53263400            48.75124400
            2     10.19201000            97.49652900
            2      4.73489200             7.86018800
            2      4.50906500            15.32975100
            d-g potential
              4
            2      8.87797700            26.96750600
            2      8.76612200            40.43230300
            2      3.17019600             3.34075800
            2      3.22885100             5.25635200
            f-g potential
              2
            2      7.82024900            -8.84752500
            2      7.83964700           -11.83551800
            -RH     0
            RH-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.19481600           225.31205400
            2      5.40513700            32.44158200
            p-g potential
              4
            2     11.28075500            52.87282600
            2     10.92724800           105.74552600
            2      5.09011700             8.61934400
            2      4.85183200            16.97345900
            d-g potential
              4
            2      9.13633700            25.10850100
            2      8.96480800            37.69573100
            2      3.64361200             4.20258400
            2      3.63600700             6.29279000
            f-g potential
              2
            2      8.61622800            -9.67356800
            2      8.62943500           -12.89984700
            -PD     0
            PD-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.79882500           240.26278900
            2      5.80052800            34.72996100
            p-g potential
              4
            2     11.87469700            56.74692900
            2     11.47433500           113.44441700
            2      5.51599900             9.34563900
            2      5.24804300            18.34544700
            d-g potential
              4
            2      8.50221200            28.59555400
            2      7.98332400            43.45392100
            2      3.10762800             1.85228600
            2      2.47673400             1.40676500
            f-g potential
              2
            2      9.67957100           -10.98725500
            2      9.69134900           -14.62619000
            -AG     0
            AG-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.5677140            255.0547710
            2      6.9976620             36.9833930
            p-g potential
              4
            2     11.3164960             60.7157050
            2     10.9580630            121.4438890
            2      7.1114000             10.1718660
            2      6.7733190             20.4865640
            d-g potential
              4
            2      8.9284370             29.5049380
            2     11.1025670             44.0187360
            2      5.5432120              5.3683330
            2      3.9288350              7.4083750
            f-g potential
              2
            2     11.0129130            -12.6234030
            2     11.0198980            -16.7643270
            -CD     0
            CD-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     13.3551760            270.0394480
            2      7.3083780             38.8777660
            p-g potential
              4
            2     12.6597280             64.6074700
            2     12.2896390            129.2194450
            2      6.7861760             10.6225580
            2      6.4007430             21.2650460
            d-g potential
              4
            2     11.1617220             31.6639650
            2     11.2196150             47.4892160
            2      4.5377330              5.1862000
            2      4.3357270              7.5660630
            f-g potential
              2
            2     11.4789860            -12.6327850
            2     11.4870270            -16.7601710
            -IN     0
            IN-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     15.3928220            281.1223500
            2      8.0558640             61.9014700
            p-g potential
              4
            2     13.9286720             67.4621540
            2     13.3472340            134.9492500
            2      7.6141320             14.7461400
            2      7.3183650             29.6392620
            d-g potential
              4
            2     14.0347150             35.4932540
            2     14.5116160             53.1787730
            2      5.5505500              9.1772810
            2      5.0594150             12.3924100
            f-g potential
              2
            2     12.5390560            -13.7280780
            2     12.5525610            -18.2068660
            -SN     0
            SN-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     17.4204140            279.9886820
            2      7.6311550             62.3778100
            p-g potential
              4
            2     16.1310240             66.1625230
            2     15.6280770            132.1743960
            2      7.3256080             16.3394170
            2      6.9425190             32.4889590
            d-g potential
              4
            2     15.5149760             36.3874410
            2     15.1881600             54.5078410
            2      5.4560240              8.6968230
            2      5.3631050             12.8402080
            f-g potential
              2
            2     12.2823480            -12.5763330
            2     12.2721500            -16.5959440
            -SB     0
            SB-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     16.3308650            281.0715810
            2      8.5565420             61.7166040
            p-g potential
              4
            2     14.4703370             67.4573800
            2     13.8161940            134.9335030
            2      8.4249240             14.7163440
            2      8.0927280             29.5185120
            d-g potential
              4
            2     14.8863310             35.4478150
            2     15.1463190             53.1434660
            2      5.9082670              9.1792230
            2      5.5943220             13.2402530
            f-g potential
              2
            2     14.4449780            -15.3668010
            2     14.4492950            -20.2961380
            -TE     0
            TE-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     16.8144730            281.0458430
            2      8.7935260             61.6206560
            p-g potential
              4
            2     14.8778010             67.4494640
            2     14.2697310            134.9043040
            2      8.7244350             14.6895470
            2      8.2915150             29.4150630
            d-g potential
              4
            2     15.2050080             35.4320570
            2     15.2258480             53.1356870
            2      6.0717690              9.0698020
            2      5.8047600             13.1223040
            f-g potential
              2
            2     15.2061680            -15.7454500
            2     15.2017020            -20.7424480
            -I     0
            I-ECP     4     28
            g potential
              1
            2      1.00000000             0.00000000
            s-g potential
              3
            2     40.03337600            49.98964900
            2     17.30057600           281.00655600
            2      8.85172000            61.41673900
            p-g potential
              4
            2     15.72014100            67.41623900
            2     15.20822200           134.80769600
            2      8.29418600            14.56654800
            2      7.75394900            28.96842200
            d-g potential
              4
            2     13.81775100            35.53875600
            2     13.58780500            53.33975900
            2      6.94763000             9.71646600
            2      6.96009900            14.97750000
            f-g potential
              4
            2     18.52295000           -20.17661800
            2     18.25103500           -26.08807700
            2      7.55790100            -0.22043400
            2      7.59740400            -0.22164600
            -XE     0
            XE-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              3
            2     40.0051840             49.9979620
            2     17.8122140            281.0133030
            2      9.3041500             61.5382550
            p-g potential
              4
            2     15.7017720             67.4391420
            2     15.2586080            134.8747110
            2      9.2921840             14.6633000
            2      8.5590030             29.3547300
            d-g potential
              6
            2     15.1856000             35.4369080
            2     14.2845000             53.1957720
            2      7.1218890              9.0462320
            2      6.9919630             13.2236810
            2      0.6239460              0.0848530
            2      0.6472840              0.0441550
            f-g potential
              4
            2     20.8815570            -23.0892950
            2     20.7834430            -30.0744750
            2      5.2533890             -0.2882270
            2      5.3611880             -0.3869240
            -HF     0
            HF-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              3
            2     10.24885600           478.23740400
            4     10.72912700             0.38802400
            2      1.96485600            -1.07123200
            p-h potential
              6
            2      8.68346200           101.04681800
            2      7.91692000           212.19776100
            4      9.37924300             0.13264600
            4      8.24420900             0.45310800
            2      1.59668600            -0.40791400
            2      1.71028100            -0.56181700
            d-h potential
              6
            2      5.18955700            43.11546700
            2      5.25322900            65.93473200
            4      5.93787100             0.02591200
            4      5.71290600             0.03374100
            2      1.01485600            -0.28057900
            2      0.47371200            -0.08484900
            f-h potential
              2
            2      1.91260800             4.81180100
            2      1.88074000             6.41857400
            g-h potential
              2
            2      2.72418000            -4.63658500
            2      2.70895300            -5.76728800
            -TA     0
            TA-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              3
            2     10.31806900           454.60064900
            4     10.54026700             2.83797500
            2      2.57472600            -0.81473600
            p-h potential
              6
            2      8.74334200            96.91078300
            2      7.91622300           195.85043200
            4      9.27573600             4.81252400
            4      8.10167500             6.33851200
            2      2.07712700            -0.45917300
            2      2.75037200            -0.64458600
            d-h potential
              6
            2      5.44731400            45.96997600
            2      5.21254500            69.63897200
            4      5.88435800             0.80293300
            4      5.64957900             0.42959500
            2      1.38818000            -0.30722700
            2      1.29439800            -0.46156000
            f-h potential
              2
            2      2.16127500             5.75777300
            2      2.12593900             7.67816700
            g-h potential
              2
            2      3.14592000            -5.68406600
            2      3.12794200            -7.06231300
            -W     0
            W-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     11.06379500           419.22759900
            2      8.21764100            41.19130700
            p-h potential
              6
            2      9.33818800           107.34811000
            2      8.43044800           214.69956800
            4      9.49002000             0.02544200
            4      9.48994700             0.05189500
            2      1.88299700            -0.11718400
            2      1.90697200             0.29668900
            d-h potential
              6
            2      6.20543300            58.88127900
            2      6.12215700            98.68355600
            4      6.27455600             0.01953700
            4      6.22637500             0.02195600
            2      1.96387500            -0.08857700
            2      1.88828700            -0.20972600
            f-h potential
              2
            2      2.30795300             6.23247200
            2      2.27060900             8.31134500
            g-h potential
              2
            2      3.58349100            -6.80294400
            2      3.56251500            -8.44323200
            -RE     0
            RE-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     12.16381400           421.97030000
            2      7.10759500            50.13443900
            p-h potential
              4
            2      9.68459700            88.48191000
            2      9.47621400           176.78722000
            2      7.66806600            10.43433800
            2      5.05515600            20.45874300
            d-h potential
              4
            2      6.50988800            43.16243100
            2      6.09121600            64.76775900
            2      4.16400600             5.34030100
            2      4.40737900             8.24333200
            f-h potential
              2
            2      2.56265800             7.24454300
            2      2.52154900             9.65926600
            g-h potential
              2
            2      4.03459900            -7.97494000
            2      4.00962800            -9.88273600
            -OS     0
            OS-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     13.00200100           424.39037600
            2      6.96276300            57.12250300
            p-h potential
              4
            2     10.49894100            88.27900300
            2      9.99252300           176.48606400
            2      6.58824800            11.71501200
            2      5.03716700            22.91500600
            d-h potential
              4
            2      7.08344100            44.77770800
            2      6.72117900            67.15364800
            2      3.79462600             5.55038700
            2      3.74812500             8.22010400
            f-h potential
              2
            2      2.82627600             8.32833200
            2      2.78119800            11.10310200
            g-h potential
              2
            2      4.49698100            -9.18134300
            2      4.46773800           -11.36160400
            -IR     0
            IR-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     13.83147400           426.95814900
            2      7.04791400            65.33881300
            p-h potential
              4
            2     11.10643300            88.07544200
            2     10.45655200           176.12477000
            2      6.37961400            12.68226000
            2      5.06472600            24.63594900
            d-h potential
              4
            2      7.54875400            46.43325800
            2      7.26530800            69.63807400
            2      3.80096900             6.15024800
            2      3.71828000             9.46356000
            f-h potential
              2
            2      3.09870600             9.48361000
            2      3.04946100            12.64274200
            g-h potential
              2
            2      4.96979000           -10.41069700
            2      4.93561400           -12.86319600
            -PT     0
            PT-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     14.60450000           429.64608700
            2      7.21828700            73.15688400
            p-h potential
              4
            2     11.57716200            88.02291700
            2     10.88384300           175.99819600
            2      6.42440300            13.68227400
            2      5.22419800            27.41465100
            d-h potential
              4
            2      7.69961000            43.55785200
            2      7.55080800            65.36910800
            2      3.96116400             7.01859600
            2      3.87277700            11.39173300
            f-h potential
              2
            2      3.37986900            10.71022000
            2      3.32625500            14.27812500
            g-h potential
              2
            2      5.45202000           -11.65174900
            2      5.41258500           -14.37552500
            -AU     0
            AU-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.5232180            426.6418670
            2      6.2643840             36.8006680
            p-h potential
              4
            2     11.4138670             87.0020910
            2     10.3292150            174.0043700
            2      5.7074240              8.8706100
            2      4.8281650             17.9024380
            d-h potential
              4
            2      7.4309630             49.8836550
            2      8.3219900             74.6845490
            2      4.6096420              6.4862270
            2      3.5115070              9.5468210
            f-h potential
              2
            2      3.0846390              8.7916400
            2      3.0247430             11.6584560
            g-h potential
              2
            2      3.9784420             -5.2343370
            2      4.0114910             -6.7381420
            -HG     0
            HG-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.4130710            275.7747970
            2      6.8979130             49.2678980
            p-h potential
              4
            2     11.3103200             80.5069840
            2     10.2107730            161.0348240
            2      5.9398040              9.0834160
            2      5.0197550             18.3677730
            d-h potential
              4
            2      8.4078950             51.1372560
            2      8.2140860             76.7074590
            2      4.0126120              6.5618210
            2      3.7953980              9.8180700
            f-h potential
              2
            2      3.2731060              9.4290010
            2      3.2083210             12.4948560
            g-h potential
              2
            2      4.4852960             -6.3384140
            2      4.5132000             -8.0998630
            -TL     0
            TL-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.1678050            281.2846630
            2      8.2949090             62.4342510
            p-h potential
              4
            2      7.1514920              4.6334080
            2      5.1728650              9.3417560
            2      9.8910720             72.2992530
            2      9.0033910            144.5580370
            d-h potential
              4
            2      7.1302180             35.9430390
            2      6.9269060             53.9095930
            2      5.4175700             10.3819390
            2      5.1386810             15.5838220
            f-h potential
              4
            2      5.6263990             15.8254880
            2      5.5489520             21.1040210
            2      2.8749460              2.9151270
            2      2.8214510              3.8969030
            g-h potential
              4
            2      6.6790570             -7.4945340
            2      6.7068350             -9.5405750
            2      7.2092840             -7.7979920
            2      7.0709640             -9.2595240
            -PB     0
            PB-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.2963030            281.2854990
            2      8.6326340             62.5202170
            p-h potential
              4
            2     10.2417900             72.2768970
            2      8.9241760            144.5910830
            2      6.5813420              4.7586930
            2      6.2554030              9.9406210
            d-h potential
              4
            2      7.7543360             35.8485070
            2      7.7202810             53.7243420
            2      4.9702640             10.1152560
            2      4.5637890             14.8337310
            f-h potential
              2
            2      3.8875120             12.2098920
            2      3.8119630             16.1902910
            g-h potential
              2
            2      5.6915770             -9.0966650
            2      5.7155670            -11.5319960
            -BI     0
            BI-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.0430900            283.2642270
            2      8.2216820             62.4719590
            p-h potential
              4
            2     10.4677770             72.0014990
            2      9.1189010            144.0022770
            2      6.7547910              5.0079450
            2      6.2525920              9.9915500
            d-h potential
              4
            2      8.0814740             36.3962590
            2      7.8905950             54.5976640
            2      4.9555560              9.9842940
            2      4.7045590             14.9814850
            f-h potential
              2
            2      4.2145460             13.7133830
            2      4.1334000             18.1943080
            g-h potential
              2
            2      6.2057090            -10.2474430
            2      6.2277820            -12.9557100
            -PO     0
            PO-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.2772270            283.2447060
            2      8.3995180             62.3964610
            p-h potential
              4
            2     10.6656820             71.9917160
            2      9.2837530            143.9718710
            2      6.8727490              4.9496150
            2      6.3261500              9.7404990
            d-h potential
              4
            2      8.2148660             36.3783830
            2      8.0086960             54.5627150
            2      5.0552270              9.8894990
            2      4.7825530             14.6938770
            f-h potential
              4
            2      5.0132700             17.4282950
            2      4.9846400             23.3803530
            2      1.3267600              0.1633920
            2      1.5287580              0.3245660
            g-h potential
              2
            2      6.7715260            -11.5632940
            2      6.7779250            -14.5097880
            -AT     0
            AT-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              3
            2     30.2008320             49.9571580
            2     13.6123060            283.2103710
            2      8.5293400             62.2810520
            p-h potential
              4
            2     10.8540650             71.9823710
            2      9.4682290            143.9035320
            2      7.0311140              4.8717590
            2      6.1438580              8.9830590
            d-h potential
              4
            2      8.3135150             36.3632370
            2      7.9989650             54.5489700
            2      5.1799660              9.7762850
            2      4.9422260             14.2647550
            f-h potential
              4
            2      5.8121630             19.8701980
            2      5.7537150             26.4164520
            2      2.5134720              0.9949700
            2      2.5362610              1.4907010
            g-h potential
              4
            2      9.8957780            -22.2232030
            2      9.7373340            -26.7154760
            2      3.0133310             -0.3730440
            2      3.0977630             -0.4859460
            -RN     0
            RN-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              3
            2     30.1512420             49.9655510
            2     14.5212410            283.0700000
            2      8.0520380             62.0028700
            p-h potential
              4
            2     11.0099420             71.9691190
            2      9.6176250            143.8605590
            2      7.3360080              4.7147610
            2      6.4062530              9.0130650
            d-h potential
              4
            2      8.3692200             36.3683650
            2      8.1169750             54.5517610
            2      5.3536560              9.6344870
            2      5.0972120             14.3879020
            f-h potential
              4
            2      6.3485710             21.7972900
            2      6.2959490             28.9468050
            2      2.8821180              1.4473650
            2      2.9080480              2.1779640
            g-h potential
              4
            2     11.0152050            -25.2280950
            2     10.9098530            -30.5661210
            2      3.4827610             -0.5748000
            2      3.6004180             -0.7795380
            
 Initial command:
 /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe "/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/M11_augccpVDZ/27_methylindane_Boat_STD/Gau-45655.inp" -scrdir="/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/M11_augccpVDZ/27_methylindane_Boat_STD/"
 Entering Link 1 = /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe PID=     45656.
  
 Copyright (c) 1988,1990,1992,1993,1995,1998,2003,2009,2016,
            Gaussian, Inc.  All Rights Reserved.
  
 This is part of the Gaussian(R) 16 program.  It is based on
 the Gaussian(R) 09 system (copyright 2009, Gaussian, Inc.),
 the Gaussian(R) 03 system (copyright 2003, Gaussian, Inc.),
 the Gaussian(R) 98 system (copyright 1998, Gaussian, Inc.),
 the Gaussian(R) 94 system (copyright 1995, Gaussian, Inc.),
 the Gaussian 92(TM) system (copyright 1992, Gaussian, Inc.),
 the Gaussian 90(TM) system (copyright 1990, Gaussian, Inc.),
 the Gaussian 88(TM) system (copyright 1988, Gaussian, Inc.),
 the Gaussian 86(TM) system (copyright 1986, Carnegie Mellon
 University), and the Gaussian 82(TM) system (copyright 1983,
 Carnegie Mellon University). Gaussian is a federally registered
 trademark of Gaussian, Inc.
  
 This software contains proprietary and confidential information,
 including trade secrets, belonging to Gaussian, Inc.
  
 This software is provided under written license and may be
 used, copied, transmitted, or stored only in accord with that
 written license.
  
 The following legend is applicable only to US Government
 contracts under FAR:
  
                    RESTRICTED RIGHTS LEGEND
  
 Use, reproduction and disclosure by the US Government is
 subject to restrictions as set forth in subparagraphs (a)
 and (c) of the Commercial Computer Software - Restricted
 Rights clause in FAR 52.227-19.
  
 Gaussian, Inc.
 340 Quinnipiac St., Bldg. 40, Wallingford CT 06492
  
  
 ---------------------------------------------------------------
 Warning -- This program may not be used in any manner that
 competes with the business of Gaussian, Inc. or will provide
 assistance to any competitor of Gaussian, Inc.  The licensee
 of this program is prohibited from giving any competitor of
 Gaussian, Inc. access to this program.  By using this program,
 the user acknowledges that Gaussian, Inc. is engaged in the
 business of creating and licensing software in the field of
 computational chemistry and represents and warrants to the
 licensee that it is not a competitor of Gaussian, Inc. and that
 it will not use this program in any manner prohibited above.
 ---------------------------------------------------------------
  

 Cite this work as:
 Gaussian 16, Revision A.03,
 M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, 
 M. A. Robb, J. R. Cheeseman, G. Scalmani, V. Barone, 
 G. A. Petersson, H. Nakatsuji, X. Li, M. Caricato, A. V. Marenich, 
 J. Bloino, B. G. Janesko, R. Gomperts, B. Mennucci, H. P. Hratchian, 
 J. V. Ortiz, A. F. Izmaylov, J. L. Sonnenberg, D. Williams-Young, 
 F. Ding, F. Lipparini, F. Egidi, J. Goings, B. Peng, A. Petrone, 
 T. Henderson, D. Ranasinghe, V. G. Zakrzewski, J. Gao, N. Rega, 
 G. Zheng, W. Liang, M. Hada, M. Ehara, K. Toyota, R. Fukuda, 
 J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, 
 T. Vreven, K. Throssell, J. A. Montgomery, Jr., J. E. Peralta, 
 F. Ogliaro, M. J. Bearpark, J. J. Heyd, E. N. Brothers, K. N. Kudin, 
 V. N. Staroverov, T. A. Keith, R. Kobayashi, J. Normand, 
 K. Raghavachari, A. P. Rendell, J. C. Burant, S. S. Iyengar, 
 J. Tomasi, M. Cossi, J. M. Millam, M. Klene, C. Adamo, R. Cammi, 
 J. W. Ochterski, R. L. Martin, K. Morokuma, O. Farkas, 
 J. B. Foresman, and D. J. Fox, Gaussian, Inc., Wallingford CT, 2016.
 
 ******************************************
 Gaussian 16:  ES64L-G16RevA.03 25-Dec-2016
                 8-Jul-2021 
 ******************************************
 %NoSave
 %nproc=16
 Will use up to   16 processors via shared memory.
 %mem=80GB
 %chk=27_methylindane_Boat_STD_M11-augccpVDZr
 ----------------------------------------------------------------------
 #P M11/Gen Integral=UltraFineGrid SCF=(NoSymm,MaxCyc=120) Polar=ROA Gu
 ess=Read Geom=Check CPHF=RdFreq
 ----------------------------------------------------------------------
 1/29=2,38=1,83=21,172=1/1;
 2/12=2,40=1/2;
 3/5=7,11=2,14=-4,25=1,30=1,36=2,74=-64,75=-5,116=-2/1,2,3;
 4/5=1,9=2/1;
 5/5=2,7=120,38=6,98=1/2;
 8/6=4,10=90,11=11/1;
 10/13=10,49=112,72=3/2;
 6/7=2,8=2,9=2,10=2,28=1/1;
 7/8=1,25=21/16;
 99/5=1/99;
 Leave Link    1 at Thu Jul  8 20:41:27 2021, MaxMem= 10737418240 cpu:               1.9 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l101.exe)
 -----------------
 ROA calculations.
 -----------------
 Structure from the checkpoint file:  "27_methylindane_Boat_STD_M11-augccpVDZr.chk"
 Charge =  0 Multiplicity = 1
 No Z-Matrix found in chk file; cartesian coordinates used.
  C                                                -2.164986000000     -1.224920000000     -0.005005000000
  C                                                -2.642020000000      0.073409000000      0.146690000000
  C                                                -1.762079000000      1.153232000000      0.130794000000
  C                                                -0.405452000000      0.917524000000     -0.034454000000
  C                                                 0.074285000000     -0.384887000000     -0.186400000000
  C                                                -0.802207000000     -1.459935000000     -0.173869000000
  C                                                 1.577720000000     -0.384146000000     -0.367381000000
  C                                                 1.970002000000      1.020984000000      0.144037000000
  C                                                 0.731931000000      1.906712000000     -0.098518000000
  H                                                -2.856720000000     -2.057467000000      0.013689000000
  H                                                -3.702276000000      0.244250000000      0.283207000000
  H                                                -2.135971000000      2.162786000000      0.253773000000
  H                                                -0.437393000000     -2.473544000000     -0.286670000000
  H                                                 1.789870000000     -0.436688000000     -1.443748000000
  C                                                 2.317593000000     -1.524644000000      0.320775000000
  H                                                 2.873170000000      1.403772000000     -0.331853000000
  H                                                 2.163642000000      0.958387000000      1.218672000000
  H                                                 0.772481000000      2.369953000000     -1.090624000000
  H                                                 0.637692000000      2.716269000000      0.626868000000
  H                                                 2.108272000000     -1.526468000000      1.392826000000
  H                                                 3.396620000000     -1.425796000000      0.184958000000
  H                                                 2.021897000000     -2.495429000000     -0.081110000000
 Recover connectivity data from disk.
 ITRead=  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0
 ITRead=  0  0
 MicOpt= -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1
 MicOpt= -1 -1
 NAtoms=     22 NQM=       22 NQMF=       0 NMMI=      0 NMMIF=      0
                NMic=       0 NMicF=      0.
                    Isotopes and Nuclear Properties:
 (Nuclear quadrupole moments (NQMom) in fm**2, nuclear magnetic moments (NMagM)
  in nuclear magnetons)

  Atom         1           2           3           4           5           6           7           8           9          10
 IAtWgt=          12          12          12          12          12          12          12          12          12           1
 AtmWgt=  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000   1.0078250
 NucSpn=           0           0           0           0           0           0           0           0           0           1
 AtZEff=   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   2.7928460
 AtZNuc=   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   1.0000000

  Atom        11          12          13          14          15          16          17          18          19          20
 IAtWgt=           1           1           1           1          12           1           1           1           1           1
 AtmWgt=   1.0078250   1.0078250   1.0078250   1.0078250  12.0000000   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250
 NucSpn=           1           1           1           1           0           1           1           1           1           1
 AtZEff=   1.0000000   1.0000000   1.0000000   1.0000000   3.6000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    2.7928460   2.7928460   2.7928460   2.7928460   0.0000000   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460
 AtZNuc=   1.0000000   1.0000000   1.0000000   1.0000000   6.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000

  Atom        21          22
 IAtWgt=           1           1
 AtmWgt=   1.0078250   1.0078250
 NucSpn=           1           1
 AtZEff=   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000
 NMagM=    2.7928460   2.7928460
 AtZNuc=   1.0000000   1.0000000
 Using perturbation frequencies:    0.085645
 Leave Link  101 at Thu Jul  8 20:41:27 2021, MaxMem= 10737418240 cpu:               2.6 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l202.exe)
                          Input orientation:                          
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0       -2.164986   -1.224920   -0.005005
      2          6           0       -2.642020    0.073409    0.146690
      3          6           0       -1.762079    1.153232    0.130794
      4          6           0       -0.405452    0.917524   -0.034454
      5          6           0        0.074285   -0.384887   -0.186400
      6          6           0       -0.802207   -1.459935   -0.173869
      7          6           0        1.577720   -0.384146   -0.367381
      8          6           0        1.970002    1.020984    0.144037
      9          6           0        0.731931    1.906712   -0.098518
     10          1           0       -2.856720   -2.057467    0.013689
     11          1           0       -3.702276    0.244250    0.283207
     12          1           0       -2.135971    2.162786    0.253773
     13          1           0       -0.437393   -2.473544   -0.286670
     14          1           0        1.789870   -0.436688   -1.443748
     15          6           0        2.317593   -1.524644    0.320775
     16          1           0        2.873170    1.403772   -0.331853
     17          1           0        2.163642    0.958387    1.218672
     18          1           0        0.772481    2.369953   -1.090624
     19          1           0        0.637692    2.716269    0.626868
     20          1           0        2.108272   -1.526468    1.392826
     21          1           0        3.396620   -1.425796    0.184958
     22          1           0        2.021897   -2.495429   -0.081110
 ---------------------------------------------------------------------
                    Distance matrix (angstroms):
                    1          2          3          4          5
     1  C    0.000000
     2  C    1.391485   0.000000
     3  C    2.415861   1.393042   0.000000
     4  C    2.772525   2.397411   1.386832   0.000000
     5  C    2.398519   2.774761   2.416331   1.396248   0.000000
     6  C    1.393167   2.416364   2.800503   2.414366   1.387128
     7  C    3.853059   4.275492   3.710252   2.395445   1.514289
     8  C    4.707911   4.708360   3.734447   2.384396   2.383150
     9  C    4.267082   3.847684   2.615416   1.508720   2.385717
    10  H    1.082580   2.145791   3.394192   3.855075   3.380584
    11  H    2.145877   1.082574   2.147986   3.379831   3.857299
    12  H    3.397699   2.152452   1.083567   2.151383   3.401415
    13  H    2.150110   3.396344   3.883629   3.400585   2.152756
    14  H    4.281609   4.736174   4.198020   2.939292   2.127637
    15  C    4.504385   5.213621   4.883732   3.674962   2.566847
    16  H    5.692088   5.693522   4.665013   3.327799   3.324788
    17  H    5.000124   5.002671   4.078324   2.858713   2.853774
    18  H    4.767640   4.296961   3.065333   2.147690   2.982322
    19  H    4.877216   4.239315   2.906557   2.181967   3.255150
    20  H    4.506173   5.165049   4.873719   3.785371   2.816783
    21  H    5.568474   6.222078   5.767711   4.471582   3.501329
    22  H    4.376068   5.329441   5.260808   4.188371   2.873789
                    6          7          8          9         10
     6  C    0.000000
     7  C    2.618935   0.000000
     8  C    3.733787   1.545906   0.000000
     9  C    3.700482   2.456761   1.541482   0.000000
    10  H    2.147847   4.754942   5.726351   5.348432   0.000000
    11  H    3.394638   5.356912   5.726903   4.750967   2.466882
    12  H    3.884059   4.545789   4.263188   2.900783   4.288083
    13  H    1.083151   2.903925   4.265300   4.537550   2.473152
    14  H    3.062432   1.098332   2.162942   2.901793   5.132431
    15  C    3.159432   1.523715   2.575321   3.803201   5.210731
    16  H    4.661992   2.208190   1.090280   2.211854   6.703075
    17  H    4.072310   2.158996   1.093735   2.164280   5.979247
    18  H    4.241241   2.959147   2.185901   1.095678   5.830322
    19  H    4.489451   3.388917   2.209563   1.091077   5.947727
    20  H    3.306032   2.164420   2.840441   3.988126   5.180263
    21  H    4.214270   2.167605   2.832604   4.276276   6.287496
    22  H    3.009388   2.176410   3.523996   4.587282   4.899153
                   11         12         13         14         15
    11  H    0.000000
    12  H    2.476885   0.000000
    13  H    4.286097   4.967172   0.000000
    14  H    5.797389   5.005104   3.232385   0.000000
    15  C    6.274490   5.782375   2.976466   2.139084   0.000000
    16  H    6.705168   5.100054   5.098573   2.407726   3.051264
    17  H    5.982815   4.568181   4.561753   3.028931   2.644875
    18  H    5.140961   3.210828   5.056639   3.006162   4.421233
    19  H    5.006426   2.852849   5.378152   3.944123   4.571772
    20  H    6.174882   5.737738   3.193442   3.055348   1.092297
    21  H    7.293355   6.594863   4.002482   2.492522   1.092024
    22  H    6.356471   6.252918   2.467963   2.479724   1.091500
                   16         17         18         19         20
    16  H    0.000000
    17  H    1.762364   0.000000
    18  H    2.433543   3.043139   0.000000
    19  H    2.763902   2.401854   1.757237   0.000000
    20  H    3.485096   2.491566   4.809777   4.555229   0.000000
    21  H    2.923619   2.876305   4.787580   4.996366   1.768875
    22  H    3.998913   3.693016   5.123680   5.438663   1.766022
                   21         22
    21  H    0.000000
    22  H    1.762036   0.000000
 Stoichiometry    C10H12
 Framework group  C1[X(C10H12)]
 Deg. of freedom    60
 Full point group                 C1      NOp   1
 RotChk:  IX=0 Diff= 5.53D-17
 Largest Abelian subgroup         C1      NOp   1
 Largest concise Abelian subgroup C1      NOp   1
                         Standard orientation:                         
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0       -2.164986   -1.224920   -0.005005
      2          6           0       -2.642020    0.073409    0.146690
      3          6           0       -1.762079    1.153232    0.130794
      4          6           0       -0.405452    0.917524   -0.034454
      5          6           0        0.074285   -0.384887   -0.186400
      6          6           0       -0.802207   -1.459935   -0.173869
      7          6           0        1.577720   -0.384146   -0.367381
      8          6           0        1.970002    1.020984    0.144037
      9          6           0        0.731931    1.906712   -0.098518
     10          1           0       -2.856720   -2.057467    0.013689
     11          1           0       -3.702276    0.244250    0.283207
     12          1           0       -2.135971    2.162786    0.253773
     13          1           0       -0.437393   -2.473544   -0.286670
     14          1           0        1.789870   -0.436688   -1.443748
     15          6           0        2.317593   -1.524644    0.320775
     16          1           0        2.873170    1.403772   -0.331853
     17          1           0        2.163642    0.958387    1.218672
     18          1           0        0.772481    2.369953   -1.090624
     19          1           0        0.637692    2.716269    0.626868
     20          1           0        2.108272   -1.526468    1.392826
     21          1           0        3.396620   -1.425796    0.184958
     22          1           0        2.021897   -2.495429   -0.081110
 ---------------------------------------------------------------------
 Rotational constants (GHZ):           2.3914598           1.2314279           0.8455004
 Leave Link  202 at Thu Jul  8 20:41:28 2021, MaxMem= 10737418240 cpu:               0.3 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l301.exe)
 General basis read from cards:  (5D, 7F)
 Centers:      10     11     12     13     14     16     17     18     19     20
 Centers:      21     22
 S 4 1.00
     Exponent=  1.3010000000D+01 Coefficients=  1.9685000000D-02
     Exponent=  1.9620000000D+00 Coefficients=  1.3797700000D-01
     Exponent=  4.4460000000D-01 Coefficients=  4.7814800000D-01
     Exponent=  1.2200000000D-01 Coefficients=  5.0124000000D-01
 S 1 1.00
     Exponent=  1.2200000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  2.9740000000D-02 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  7.2700000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  1.4100000000D-01 Coefficients=  1.0000000000D+00
 ****
 Centers:       1      2      3      4      5      6      7      8      9     15
 S 9 1.00
     Exponent=  6.6650000000D+03 Coefficients=  6.9200000000D-04
     Exponent=  1.0000000000D+03 Coefficients=  5.3290000000D-03
     Exponent=  2.2800000000D+02 Coefficients=  2.7077000000D-02
     Exponent=  6.4710000000D+01 Coefficients=  1.0171800000D-01
     Exponent=  2.1060000000D+01 Coefficients=  2.7474000000D-01
     Exponent=  7.4950000000D+00 Coefficients=  4.4856400000D-01
     Exponent=  2.7970000000D+00 Coefficients=  2.8507400000D-01
     Exponent=  5.2150000000D-01 Coefficients=  1.5204000000D-02
     Exponent=  1.5960000000D-01 Coefficients= -3.1910000000D-03
 S 9 1.00
     Exponent=  6.6650000000D+03 Coefficients= -1.4600000000D-04
     Exponent=  1.0000000000D+03 Coefficients= -1.1540000000D-03
     Exponent=  2.2800000000D+02 Coefficients= -5.7250000000D-03
     Exponent=  6.4710000000D+01 Coefficients= -2.3312000000D-02
     Exponent=  2.1060000000D+01 Coefficients= -6.3955000000D-02
     Exponent=  7.4950000000D+00 Coefficients= -1.4998100000D-01
     Exponent=  2.7970000000D+00 Coefficients= -1.2726200000D-01
     Exponent=  5.2150000000D-01 Coefficients=  5.4452900000D-01
     Exponent=  1.5960000000D-01 Coefficients=  5.8049600000D-01
 S 1 1.00
     Exponent=  1.5960000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  4.6900000000D-02 Coefficients=  1.0000000000D+00
 P 4 1.00
     Exponent=  9.4390000000D+00 Coefficients=  3.8109000000D-02
     Exponent=  2.0020000000D+00 Coefficients=  2.0948000000D-01
     Exponent=  5.4560000000D-01 Coefficients=  5.0855700000D-01
     Exponent=  1.5170000000D-01 Coefficients=  4.6884200000D-01
 P 1 1.00
     Exponent=  1.5170000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  4.0410000000D-02 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  5.5000000000D-01 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  1.5100000000D-01 Coefficients=  1.0000000000D+00
 ****
 Ernie: Thresh=  0.10000D-02 Tol=  0.10000D-05 Strict=F.
 Ernie:  30 primitive shells out of 376 were deleted.
 There are   358 symmetry adapted cartesian basis functions of A   symmetry.
 There are   338 symmetry adapted basis functions of A   symmetry.
   338 basis functions,   614 primitive gaussians,   358 cartesian basis functions
    36 alpha electrons       36 beta electrons
       nuclear repulsion energy       504.1844683919 Hartrees.
 IExCor= 5042 DFT=T Ex+Corr=M11 ExCW=0 ScaHFX=  1.000000
 ScaDFX=  1.000000  1.000000  1.000000  1.000000 ScalE2=  1.000000  1.000000
 IRadAn=      5 IRanWt=     -1 IRanGd=            0 ICorTp=0 IEmpDi=  4
 HFx  wShort=  0.000000 wLong=  0.250000 cFull=  0.428000 cShort=  0.000000 cLong=  0.572000
 DFx  wShort=  0.000000 wLong=  0.250000 cFull=  0.000000 cShort=  0.000000 cLong=  1.000000
 NAtoms=   22 NActive=   22 NUniq=   22 SFac= 1.00D+00 NAtFMM=   60 NAOKFM=F Big=F
 Integral buffers will be    131072 words long.
 Raffenetti 2 integral format.
 Two-electron integral symmetry is turned on.
 Leave Link  301 at Thu Jul  8 20:41:30 2021, MaxMem= 10737418240 cpu:              33.9 elap:               2.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l302.exe)
 NPDir=0 NMtPBC=     1 NCelOv=     1 NCel=       1 NClECP=     1 NCelD=      1
         NCelK=      1 NCelE2=     1 NClLst=     1 CellRange=     0.0.
 One-electron integrals computed using PRISM.
 One-electron integral symmetry used in STVInt
 NBasis=   338 RedAO= T EigKep=  1.42D-06  NBF=   338
 NBsUse=   338 1.00D-06 EigRej= -1.00D+00 NBFU=   338
 Precomputing XC quadrature grid using
 IXCGrd= 4 IRadAn=           5 IRanWt=          -1 IRanGd=           0 AccXCQ= 0.00D+00.
 Generated NRdTot=       0 NPtTot=           0 NUsed=           0 NTot=          32
 NSgBfM=   358   358   358   358   358 MxSgAt=    22 MxSgA2=    22.
 Leave Link  302 at Thu Jul  8 20:41:31 2021, MaxMem= 10737418240 cpu:               8.8 elap:               0.6
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l303.exe)
 DipDrv:  MaxL=2.
 Leave Link  303 at Thu Jul  8 20:41:31 2021, MaxMem= 10737418240 cpu:               1.9 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l401.exe)
 Initial guess from the checkpoint file:  "27_methylindane_Boat_STD_M11-augccpVDZr.chk"
 SCF N**3 symmetry information disabled.
 B after Tr=     0.000000   -0.000000    0.000000
         Rot=    1.000000   -0.000000    0.000000   -0.000000 Ang=   0.00 deg.
 Guess basis will be translated and rotated to current coordinates.
 JPrj=2 DoOrth=T DoCkMO=T.
 Leave Link  401 at Thu Jul  8 20:41:32 2021, MaxMem= 10737418240 cpu:               9.3 elap:               0.7
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l502.exe)
 Integral symmetry usage will be decided dynamically.
 Closed shell SCF:
 Using DIIS extrapolation, IDIIS=  1040.
 NGot= 10737418240 LenX= 10737152694 LenY= 10737024089
 Requested convergence on RMS density matrix=1.00D-08 within 120 cycles.
 Requested convergence on MAX density matrix=1.00D-06.
 Requested convergence on             energy=1.00D-06.
 No special actions if energy rises.
 Fock matrices will be formed incrementally for  20 cycles.

 Cycle   1  Pass 1  IDiag  1:
 FoFJK:  IHMeth= 1 ICntrl=       0 DoSepK=T KAlg= 0 I1Cent=           0 FoldK=F
 IRaf=         1 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=T BraDBF=F KetDBF=F FulRan=T
         wScrn=  0.000000 ICntrl=       500 IOpCl=  0 I1Cent=           0 NGrid=           0
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 E= -388.065435828905    
 DIIS: error= 2.82D-03 at cycle   1 NSaved=   1.
 NSaved= 1 IEnMin= 1 EnMin= -388.065435828905     IErMin= 1 ErrMin= 2.82D-03
 ErrMax= 2.82D-03  0.00D+00 EMaxC= 1.00D-01 BMatC= 9.98D-03 BMatP= 9.98D-03
 IDIUse=3 WtCom= 9.72D-01 WtEn= 2.82D-02
 Coeff-Com:  0.100D+01
 Coeff-En:   0.100D+01
 Coeff:      0.100D+01
 Gap=     0.391 Goal=   None    Shift=    0.000
 GapD=    0.391 DampG=1.000 DampE=1.000 DampFc=1.0000 IDamp=-1.
 RMSDP=8.88D-02 MaxDP=6.16D+00              OVMax= 1.62D-02

 Cycle   2  Pass 1  IDiag  1:
 RMSU=  6.53D-02    CP:  2.05D+00
 E= -388.075236350672     Delta-E=       -0.009800521766 Rises=F Damp=F
 DIIS: error= 4.36D-04 at cycle   2 NSaved=   2.
 NSaved= 2 IEnMin= 2 EnMin= -388.075236350672     IErMin= 2 ErrMin= 4.36D-04
 ErrMax= 4.36D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.76D-04 BMatP= 9.98D-03
 IDIUse=3 WtCom= 9.96D-01 WtEn= 4.36D-03
 Coeff-Com: -0.653D-01 0.107D+01
 Coeff-En:   0.000D+00 0.100D+01
 Coeff:     -0.651D-01 0.107D+01
 Gap=     0.317 Goal=   None    Shift=    0.000
 RMSDP=1.83D-02 MaxDP=1.35D+00 DE=-9.80D-03 OVMax= 3.93D-03

 Cycle   3  Pass 1  IDiag  1:
 RMSU=  2.64D-03    CP:  2.26D+00  1.21D+00
 E= -388.075502138389     Delta-E=       -0.000265787717 Rises=F Damp=F
 DIIS: error= 2.61D-04 at cycle   3 NSaved=   3.
 NSaved= 3 IEnMin= 3 EnMin= -388.075502138389     IErMin= 3 ErrMin= 2.61D-04
 ErrMax= 2.61D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.65D-05 BMatP= 1.76D-04
 IDIUse=3 WtCom= 9.97D-01 WtEn= 2.61D-03
 Coeff-Com: -0.257D-01 0.240D+00 0.785D+00
 Coeff-En:   0.000D+00 0.000D+00 0.100D+01
 Coeff:     -0.257D-01 0.240D+00 0.786D+00
 Gap=     0.319 Goal=   None    Shift=    0.000
 RMSDP=1.54D-03 MaxDP=1.05D-01 DE=-2.66D-04 OVMax= 1.49D-03

 Cycle   4  Pass 1  IDiag  1:
 RMSU=  3.69D-04    CP:  2.28D+00  1.23D+00  1.12D+00
 E= -388.075529708272     Delta-E=       -0.000027569883 Rises=F Damp=F
 DIIS: error= 6.89D-05 at cycle   4 NSaved=   4.
 NSaved= 4 IEnMin= 4 EnMin= -388.075529708272     IErMin= 4 ErrMin= 6.89D-05
 ErrMax= 6.89D-05  0.00D+00 EMaxC= 1.00D-01 BMatC= 4.88D-06 BMatP= 2.65D-05
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.891D-03-0.512D-01 0.251D+00 0.801D+00
 Coeff:     -0.891D-03-0.512D-01 0.251D+00 0.801D+00
 Gap=     0.318 Goal=   None    Shift=    0.000
 RMSDP=3.54D-04 MaxDP=2.46D-02 DE=-2.76D-05 OVMax= 8.59D-04

 Cycle   5  Pass 1  IDiag  1:
 RMSU=  1.48D-04    CP:  2.28D+00  1.23D+00  1.18D+00  1.05D+00
 E= -388.075535126705     Delta-E=       -0.000005418433 Rises=F Damp=F
 DIIS: error= 2.16D-05 at cycle   5 NSaved=   5.
 NSaved= 5 IEnMin= 5 EnMin= -388.075535126705     IErMin= 5 ErrMin= 2.16D-05
 ErrMax= 2.16D-05  0.00D+00 EMaxC= 1.00D-01 BMatC= 5.41D-07 BMatP= 4.88D-06
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.176D-02-0.398D-01 0.387D-01 0.313D+00 0.687D+00
 Coeff:      0.176D-02-0.398D-01 0.387D-01 0.313D+00 0.687D+00
 Gap=     0.318 Goal=   None    Shift=    0.000
 RMSDP=7.17D-05 MaxDP=2.55D-03 DE=-5.42D-06 OVMax= 2.74D-04

 Cycle   6  Pass 1  IDiag  1:
 RMSU=  4.42D-05    CP:  2.28D+00  1.23D+00  1.19D+00  1.17D+00  1.13D+00
 E= -388.075535709481     Delta-E=       -0.000000582776 Rises=F Damp=F
 DIIS: error= 7.88D-06 at cycle   6 NSaved=   6.
 NSaved= 6 IEnMin= 6 EnMin= -388.075535709481     IErMin= 6 ErrMin= 7.88D-06
 ErrMax= 7.88D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 3.77D-08 BMatP= 5.41D-07
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.533D-03-0.459D-02-0.178D-01-0.429D-02 0.198D+00 0.828D+00
 Coeff:      0.533D-03-0.459D-02-0.178D-01-0.429D-02 0.198D+00 0.828D+00
 Gap=     0.318 Goal=   None    Shift=    0.000
 RMSDP=2.15D-05 MaxDP=1.18D-03 DE=-5.83D-07 OVMax= 1.28D-04

 Cycle   7  Pass 1  IDiag  1:
 RMSU=  9.96D-06    CP:  2.28D+00  1.23D+00  1.19D+00  1.18D+00  1.18D+00
                    CP:  9.93D-01
 E= -388.075535767465     Delta-E=       -0.000000057984 Rises=F Damp=F
 DIIS: error= 2.00D-06 at cycle   7 NSaved=   7.
 NSaved= 7 IEnMin= 7 EnMin= -388.075535767465     IErMin= 7 ErrMin= 2.00D-06
 ErrMax= 2.00D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.80D-09 BMatP= 3.77D-08
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.309D-04 0.218D-02-0.677D-02-0.254D-01-0.219D-01 0.174D+00
 Coeff-Com:  0.878D+00
 Coeff:     -0.309D-04 0.218D-02-0.677D-02-0.254D-01-0.219D-01 0.174D+00
 Coeff:      0.878D+00
 Gap=     0.318 Goal=   None    Shift=    0.000
 RMSDP=8.52D-06 MaxDP=5.39D-04 DE=-5.80D-08 OVMax= 3.22D-05

 Cycle   8  Pass 1  IDiag  1:
 RMSU=  2.66D-06    CP:  2.28D+00  1.23D+00  1.19D+00  1.19D+00  1.20D+00
                    CP:  1.03D+00  1.25D+00
 E= -388.075535772902     Delta-E=       -0.000000005437 Rises=F Damp=F
 DIIS: error= 9.77D-07 at cycle   8 NSaved=   8.
 NSaved= 8 IEnMin= 8 EnMin= -388.075535772902     IErMin= 8 ErrMin= 9.77D-07
 ErrMax= 9.77D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 4.58D-10 BMatP= 2.80D-09
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.672D-04 0.124D-02-0.699D-03-0.851D-02-0.316D-01-0.267D-01
 Coeff-Com:  0.296D+00 0.770D+00
 Coeff:     -0.672D-04 0.124D-02-0.699D-03-0.851D-02-0.316D-01-0.267D-01
 Coeff:      0.296D+00 0.770D+00
 Gap=     0.318 Goal=   None    Shift=    0.000
 RMSDP=2.33D-06 MaxDP=1.05D-04 DE=-5.44D-09 OVMax= 1.86D-05

 Cycle   9  Pass 1  IDiag  1:
 RMSU=  1.02D-06    CP:  2.28D+00  1.23D+00  1.19D+00  1.19D+00  1.21D+00
                    CP:  1.05D+00  1.37D+00  1.22D+00
 E= -388.075535773896     Delta-E=       -0.000000000994 Rises=F Damp=F
 DIIS: error= 3.87D-07 at cycle   9 NSaved=   9.
 NSaved= 9 IEnMin= 9 EnMin= -388.075535773896     IErMin= 9 ErrMin= 3.87D-07
 ErrMax= 3.87D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 4.03D-11 BMatP= 4.58D-10
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.864D-05-0.359D-03 0.829D-03 0.423D-02 0.391D-02-0.183D-01
 Coeff-Com: -0.136D+00-0.556D-01 0.120D+01
 Coeff:      0.864D-05-0.359D-03 0.829D-03 0.423D-02 0.391D-02-0.183D-01
 Coeff:     -0.136D+00-0.556D-01 0.120D+01
 Gap=     0.318 Goal=   None    Shift=    0.000
 RMSDP=2.56D-06 MaxDP=1.75D-04 DE=-9.94D-10 OVMax= 1.24D-05

 Cycle  10  Pass 1  IDiag  1:
 RMSU=  4.28D-07    CP:  2.28D+00  1.23D+00  1.19D+00  1.19D+00  1.20D+00
                    CP:  1.05D+00  1.44D+00  1.40D+00  1.36D+00
 E= -388.075535774119     Delta-E=       -0.000000000223 Rises=F Damp=F
 DIIS: error= 1.16D-07 at cycle  10 NSaved=  10.
 NSaved=10 IEnMin=10 EnMin= -388.075535774119     IErMin=10 ErrMin= 1.16D-07
 ErrMax= 1.16D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 8.26D-12 BMatP= 4.03D-11
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.981D-05-0.234D-03 0.300D-03 0.212D-02 0.470D-02-0.357D-03
 Coeff-Com: -0.673D-01-0.107D+00 0.283D+00 0.884D+00
 Coeff:      0.981D-05-0.234D-03 0.300D-03 0.212D-02 0.470D-02-0.357D-03
 Coeff:     -0.673D-01-0.107D+00 0.283D+00 0.884D+00
 Gap=     0.318 Goal=   None    Shift=    0.000
 RMSDP=4.31D-07 MaxDP=1.97D-05 DE=-2.23D-10 OVMax= 4.44D-06

 Cycle  11  Pass 1  IDiag  1:
 RMSU=  1.51D-07    CP:  2.28D+00  1.23D+00  1.19D+00  1.19D+00  1.20D+00
                    CP:  1.05D+00  1.45D+00  1.43D+00  1.52D+00  1.30D+00
 E= -388.075535774122     Delta-E=       -0.000000000002 Rises=F Damp=F
 DIIS: error= 6.47D-08 at cycle  11 NSaved=  11.
 NSaved=11 IEnMin=11 EnMin= -388.075535774122     IErMin=11 ErrMin= 6.47D-08
 ErrMax= 6.47D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.69D-12 BMatP= 8.26D-12
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.108D-06 0.408D-04-0.160D-03-0.699D-03-0.313D-04 0.498D-02
 Coeff-Com:  0.222D-01-0.106D-01-0.269D+00 0.165D+00 0.109D+01
 Coeff:      0.108D-06 0.408D-04-0.160D-03-0.699D-03-0.313D-04 0.498D-02
 Coeff:      0.222D-01-0.106D-01-0.269D+00 0.165D+00 0.109D+01
 Gap=     0.318 Goal=   None    Shift=    0.000
 RMSDP=2.46D-07 MaxDP=9.26D-06 DE=-2.16D-12 OVMax= 2.83D-06

 Cycle  12  Pass 1  IDiag  1:
 RMSU=  8.40D-08    CP:  2.28D+00  1.23D+00  1.19D+00  1.19D+00  1.20D+00
                    CP:  1.05D+00  1.45D+00  1.44D+00  1.62D+00  1.57D+00
                    CP:  1.64D+00
 E= -388.075535774145     Delta-E=       -0.000000000024 Rises=F Damp=F
 DIIS: error= 1.87D-08 at cycle  12 NSaved=  12.
 NSaved=12 IEnMin=12 EnMin= -388.075535774145     IErMin=12 ErrMin= 1.87D-08
 ErrMax= 1.87D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.73D-13 BMatP= 1.69D-12
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.111D-05 0.362D-04-0.702D-04-0.410D-03-0.529D-03 0.109D-02
 Coeff-Com:  0.131D-01 0.916D-02-0.944D-01-0.611D-01 0.265D+00 0.868D+00
 Coeff:     -0.111D-05 0.362D-04-0.702D-04-0.410D-03-0.529D-03 0.109D-02
 Coeff:      0.131D-01 0.916D-02-0.944D-01-0.611D-01 0.265D+00 0.868D+00
 Gap=     0.318 Goal=   None    Shift=    0.000
 RMSDP=1.03D-07 MaxDP=8.31D-06 DE=-2.38D-11 OVMax= 5.97D-07

 Cycle  13  Pass 1  IDiag  1:
 RMSU=  1.77D-08    CP:  2.28D+00  1.23D+00  1.19D+00  1.19D+00  1.20D+00
                    CP:  1.05D+00  1.45D+00  1.44D+00  1.64D+00  1.61D+00
                    CP:  1.84D+00  1.21D+00
 E= -388.075535774105     Delta-E=        0.000000000040 Rises=F Damp=F
 DIIS: error= 7.26D-09 at cycle  13 NSaved=  13.
 NSaved=13 IEnMin=12 EnMin= -388.075535774145     IErMin=13 ErrMin= 7.26D-09
 ErrMax= 7.26D-09  0.00D+00 EMaxC= 1.00D-01 BMatC= 3.63D-14 BMatP= 1.73D-13
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.439D-06 0.903D-05-0.730D-05-0.735D-04-0.188D-03-0.225D-03
 Coeff-Com:  0.244D-02 0.467D-02-0.341D-02-0.439D-01-0.319D-01 0.337D+00
 Coeff-Com:  0.735D+00
 Coeff:     -0.439D-06 0.903D-05-0.730D-05-0.735D-04-0.188D-03-0.225D-03
 Coeff:      0.244D-02 0.467D-02-0.341D-02-0.439D-01-0.319D-01 0.337D+00
 Coeff:      0.735D+00
 Gap=     0.318 Goal=   None    Shift=    0.000
 RMSDP=3.25D-08 MaxDP=2.57D-06 DE= 4.02D-11 OVMax= 1.72D-07

 Cycle  14  Pass 1  IDiag  1:
 RMSU=  8.19D-09    CP:  2.28D+00  1.23D+00  1.19D+00  1.19D+00  1.20D+00
                    CP:  1.05D+00  1.45D+00  1.44D+00  1.64D+00  1.61D+00
                    CP:  1.90D+00  1.32D+00  1.14D+00
 E= -388.075535774117     Delta-E=       -0.000000000012 Rises=F Damp=F
 DIIS: error= 1.91D-09 at cycle  14 NSaved=  14.
 NSaved=14 IEnMin=12 EnMin= -388.075535774145     IErMin=14 ErrMin= 1.91D-09
 ErrMax= 1.91D-09  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.52D-15 BMatP= 3.63D-14
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.118D-06-0.430D-05 0.931D-05 0.509D-04 0.622D-04-0.221D-03
 Coeff-Com: -0.160D-02-0.793D-03 0.135D-01 0.282D-02-0.438D-01-0.832D-01
 Coeff-Com:  0.111D+00 0.100D+01
 Coeff:      0.118D-06-0.430D-05 0.931D-05 0.509D-04 0.622D-04-0.221D-03
 Coeff:     -0.160D-02-0.793D-03 0.135D-01 0.282D-02-0.438D-01-0.832D-01
 Coeff:      0.111D+00 0.100D+01
 Gap=     0.318 Goal=   None    Shift=    0.000
 RMSDP=9.91D-09 MaxDP=7.00D-07 DE=-1.21D-11 OVMax= 5.80D-08

 SCF Done:  E(RM11) =  -388.075535774     A.U. after   14 cycles
            NFock= 14  Conv=0.99D-08     -V/T= 2.0063
 KE= 3.856409444541D+02 PE=-1.907275840442D+03 EE= 6.293748918214D+02
 Leave Link  502 at Thu Jul  8 20:45:51 2021, MaxMem= 10737418240 cpu:            4119.4 elap:             257.9
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l801.exe)
 DoSCS=F DFT=T ScalE2(SS,OS)=  1.000000  1.000000
 Range of M.O.s used for correlation:     1   338
 NBasis=   338 NAE=    36 NBE=    36 NFC=     0 NFV=     0
 NROrb=    338 NOA=    36 NOB=    36 NVA=   302 NVB=   302

 **** Warning!!: The largest alpha MO coefficient is  0.11529474D+03

 Leave Link  801 at Thu Jul  8 20:45:51 2021, MaxMem= 10737418240 cpu:               0.9 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1002.exe)
 Minotr:  Closed shell wavefunction.
          Direct CPHF calculation.
          Differentiating once with respect to electric field.
                with respect to dipole field.
                with respect to quadrupole field.
          Differentiating once with respect to magnetic field using GIAOs.
          Electric field/nuclear overlap derivatives assumed to be zero.
          Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum.
          Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum.
          NewPWx=F KeepS1=T KeepF1=T KeepIn=T MapXYZ=F SortEE=F KeepMc=T.
         6795 words used for storage of precomputed grid.
 Two-electron integral symmetry used by symmetrizing perturbed Fock matrices.
          MDV=   10737418240 using IRadAn=       1.
          Solving linear equations simultaneously, MaxMat=     384.
          Doing perturbations at frequencies    0.085645
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=F BraDBF=F KetDBF=T FulRan=T
         wScrn=  0.000000 ICntrl=      6100 IOpCl=  0 I1Cent=           7 NGrid=          22
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 FoFJK:  IHMeth= 1 ICntrl=    6127 DoSepK=T KAlg= 0 I1Cent=           0 FoldK=F
 IRaf=         1 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 CalDSu exits because no D1Ps are significant.
          There are    12 degrees of freedom in the 1st order CPHF.  IDoFFX=0 NUNeed=    12.
     11 vectors produced by pass  0 Test12= 1.81D-13 8.33D-09 XBig12= 1.00D+00 2.80D-01.
 AX will form    11 AO Fock derivatives at one time.
     11 vectors produced by pass  1 Test12= 1.81D-13 8.33D-09 XBig12= 1.81D-01 5.16D-02.
     11 vectors produced by pass  2 Test12= 1.81D-13 8.33D-09 XBig12= 3.00D-02 4.60D-02.
     11 vectors produced by pass  3 Test12= 1.81D-13 8.33D-09 XBig12= 2.69D-03 1.16D-02.
     11 vectors produced by pass  4 Test12= 1.81D-13 8.33D-09 XBig12= 3.20D-04 2.94D-03.
     11 vectors produced by pass  5 Test12= 1.81D-13 8.33D-09 XBig12= 2.10D-05 4.82D-04.
     11 vectors produced by pass  6 Test12= 1.81D-13 8.33D-09 XBig12= 7.23D-07 1.27D-04.
     11 vectors produced by pass  7 Test12= 1.81D-13 8.33D-09 XBig12= 1.53D-08 2.17D-05.
     11 vectors produced by pass  8 Test12= 1.81D-13 8.33D-09 XBig12= 5.03D-10 3.63D-06.
     11 vectors produced by pass  9 Test12= 1.81D-13 8.33D-09 XBig12= 1.41D-11 5.66D-07.
      7 vectors produced by pass 10 Test12= 1.81D-13 8.33D-09 XBig12= 3.03D-13 7.24D-08.
      2 vectors produced by pass 11 Test12= 1.81D-13 8.33D-09 XBig12= 1.08D-14 1.28D-08.
 InvSVY:  IOpt=1 It=  1 EMax= 2.84D-14
 Solved reduced A of dimension   119 with    12 vectors.
 FullF1:  Do perturbations      1 to      12.
 SCF Polarizability for W=    0.085645:
                1             2             3 
      1  0.147336D+03
      2  0.185567D+01  0.129405D+03
      3 -0.348524D+01  0.148588D+01  0.825990D+02
 Isotropic polarizability for W=    0.085645      119.78 Bohr**3.
 Dipole-quadrupole polarizability for W=    0.085645:
                 1             2             3 
      1  -0.739893D+02 -0.151899D+02  0.137173D+02
      2   0.387046D+02  0.160041D+01 -0.137562D+02
      3   0.352847D+02  0.135895D+02  0.388817D-01
      4  -0.275242D+02 -0.332348D+02 -0.108300D+02
      5   0.149339D+02 -0.138474D+02  0.323531D+02
      6  -0.723586D+01 -0.125287D+01  0.731315D+00
 Dipole-magnetic dipole polarizability for W=    0.085645:
                 1             2             3 
      1   0.439693D+00  0.959180D+00  0.196300D+01
      2   0.103121D+02 -0.566690D+01  0.126949D+02
      3   0.448778D+00  0.320528D+02  0.520413D+01
 DQ contribution to OR G for W=    0.085645:
                 1             2             3 
      1  -0.301734D+01  0.125033D+02  0.128582D+02
      2  -0.121658D+01 -0.359417D+01 -0.293157D+01
      3  -0.123342D+02  0.719394D+02  0.661152D+01
 Optical Rotation G' tensor for W=    0.085645:
                 1             2             3 
      1  -0.985719D+00 -0.140697D+01 -0.537448D+00
      2  -0.140697D+01  0.192337D+01 -0.256093D+01
      3  -0.537448D+00 -0.256093D+01 -0.960726D+00
 OR G Eigenvalues:    -3.1404    -0.5061     3.6235  Iso=     0.0077
 Eigenvectors:
   (1)   0.501372   0.497366   0.707992
   (2)   0.839290  -0.080698  -0.537662
   (3)  -0.210281   0.863780  -0.457894
 w=    0.085645 a.u., Optical Rotation Beta=      0.0077 au.
 Molar Mass =    132.2048 grams/mole, [Alpha] ( 5320.0 A) =        2.76 deg.
 PxScal for PaGxPb-FJK:  IOpCl= 0 ISclPx=1 IMOff=     1 NMtTot=    25 NTT=   57291 ScalPx= 3.49D+02
 PxSclF for G(T1ab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=   57291 IRwP= 19996     0 IPTmp= 19977     0 ScalPx= 2.95D+03
 FullF1:  Do perturbations      1 to      30.
          There are    36 degrees of freedom in the 2nd order CPHF.
     30 vectors produced by pass  0 Test12= 3.02D-14 2.78D-09 XBig12= 1.00D+00 3.94D-01.
     30 vectors produced by pass  1 Test12= 3.02D-14 2.78D-09 XBig12= 3.43D-02 2.55D-02.
     30 vectors produced by pass  2 Test12= 3.02D-14 2.78D-09 XBig12= 1.19D-03 4.10D-03.
     30 vectors produced by pass  3 Test12= 3.02D-14 2.78D-09 XBig12= 1.81D-05 5.30D-04.
     30 vectors produced by pass  4 Test12= 3.02D-14 2.78D-09 XBig12= 2.63D-07 5.73D-05.
     30 vectors produced by pass  5 Test12= 3.02D-14 2.78D-09 XBig12= 4.68D-09 7.40D-06.
     30 vectors produced by pass  6 Test12= 3.02D-14 2.78D-09 XBig12= 6.12D-11 7.58D-07.
     30 vectors produced by pass  7 Test12= 3.02D-14 2.78D-09 XBig12= 6.07D-13 8.16D-08.
     16 vectors produced by pass  8 Test12= 3.02D-14 2.78D-09 XBig12= 8.48D-15 1.58D-08.
      4 vectors produced by pass  9 Test12= 3.02D-14 2.78D-09 XBig12= 7.09D-16 3.95D-09.
      2 vectors produced by pass 10 Test12= 3.02D-14 2.78D-09 XBig12= 1.51D-15 5.80D-09.
 InvSVY:  IOpt=1 It=  1 EMax= 2.33D-15
 Solved reduced A of dimension   262 with    30 vectors.
 PxScal for FxTab-FJK:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=   57291 ScalPx= 8.12D+03
 PxScal for FxTab-XC:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=   57291 ScalPx= 8.12D+03
 PxSclF for G(Xab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=   57291 IRwP= 19978     0 IPTmp= 19973     0 ScalPx= 8.36D+03
 FullF1:  Do perturbations      1 to      30.
 End of Minotr F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) frequency  1    0.085645:
                 1             2             3 
      1   0.147336D+03  0.185567D+01 -0.348524D+01
      2   0.185567D+01  0.129405D+03  0.148588D+01
      3  -0.348524D+01  0.148588D+01  0.825990D+02
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.085645:
                 1             2             3 
      1   0.439693D+00  0.959180D+00  0.196300D+01
      2   0.103121D+02 -0.566690D+01  0.126949D+02
      3   0.448778D+00  0.320528D+02  0.520413D+01
 Property number 4 -- D-Q polarizability frequency  1    0.085645:
                 1             2             3 
      1  -0.739893D+02 -0.151899D+02  0.137173D+02
      2   0.387046D+02  0.160041D+01 -0.137562D+02
      3   0.352847D+02  0.135895D+02  0.388817D-01
      4  -0.275242D+02 -0.332348D+02 -0.108300D+02
      5   0.149339D+02 -0.138474D+02  0.323531D+02
      6  -0.723586D+01 -0.125287D+01  0.731315D+00
 End of Minotr F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=    66 ND12= 1 LenFil=    2379:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.274744D+00 -0.991059D+00 -0.760802D+00 -0.517803D+01 -0.849824D-01
      2  -0.991059D+00 -0.234371D+01 -0.669696D+00 -0.849824D-01 -0.241399D+01
      3  -0.760802D+00 -0.669696D+00 -0.166928D+01  0.536409D+00  0.537188D+00
                 6             7             8             9            10 
      1   0.536409D+00 -0.127094D+01 -0.116130D+00 -0.351904D+01 -0.458644D+01
      2   0.537188D+00 -0.116130D+00  0.410147D+00 -0.381165D+01  0.760262D+00
      3  -0.299240D+01 -0.351904D+01 -0.381165D+01 -0.193151D-01 -0.652399D+00
                11            12            13            14            15 
      1   0.760262D+00 -0.652399D+00  0.152116D+01  0.222966D+01  0.321305D+00
      2  -0.266749D+01  0.218451D-01  0.222966D+01  0.230589D+01 -0.409139D+00
      3   0.218451D-01 -0.305814D+01  0.321305D+00 -0.409139D+00  0.942836D+00
                16            17            18            19            20 
      1  -0.691389D+00  0.635175D+00 -0.526390D+01  0.909929D+00 -0.290783D+01
      2   0.635175D+00  0.273150D+00  0.691569D+00 -0.290783D+01 -0.356950D+01
      3  -0.526390D+01  0.691569D+00  0.145900D+01 -0.258796D+00  0.501833D+00
                21            22            23            24            25 
      1  -0.258796D+00  0.511129D+01 -0.366558D+00 -0.382540D-01  0.174581D+00
      2   0.501833D+00 -0.366558D+00  0.409690D+00 -0.467934D+00  0.937832D+00
      3  -0.569120D+00 -0.382540D-01 -0.467934D+00  0.265318D+01 -0.234999D+01
                26            27            28            29            30 
      1   0.937832D+00 -0.234999D+01  0.795231D+00  0.269264D+01 -0.274896D+00
      2  -0.526184D+00  0.346363D+01  0.269264D+01  0.706098D+01 -0.160221D+00
      3   0.346363D+01  0.145536D+01 -0.274896D+00 -0.160221D+00  0.194627D+01
                31            32            33            34            35 
      1   0.115214D+02  0.422049D+01 -0.907754D+00  0.164371D+01 -0.285209D+00
      2   0.422049D+01  0.631953D+01 -0.519789D+00 -0.285209D+00 -0.287044D+00
      3  -0.907754D+00 -0.519789D+00  0.154004D+01  0.149605D+01  0.296052D+01
                36            37            38            39            40 
      1   0.149605D+01  0.148039D+02 -0.172945D+01 -0.186067D+01 -0.599777D+01
      2   0.296052D+01 -0.172945D+01  0.365250D+01  0.646646D-01 -0.315640D+01
      3  -0.981834D-01 -0.186067D+01  0.646646D-01  0.235530D+01 -0.102178D+00
                41            42            43            44            45 
      1  -0.315640D+01 -0.102178D+00 -0.143974D+01 -0.444659D+00  0.308203D+01
      2  -0.419933D+00  0.518917D+00 -0.444659D+00  0.415877D+00 -0.834944D+00
      3   0.518917D+00  0.338543D+00  0.308203D+01 -0.834944D+00 -0.136161D+01
                46            47            48            49            50 
      1  -0.154357D+01  0.323572D+01  0.370619D+00 -0.558529D+01  0.521285D+00
      2   0.323572D+01  0.199011D+01 -0.329997D+00  0.521285D+00 -0.193423D+01
      3   0.370619D+00 -0.329997D+00  0.112965D+01  0.177696D+00  0.372397D+00
                51            52            53            54            55 
      1   0.177696D+00  0.913174D-01 -0.508875D+00  0.391075D+00 -0.363358D+01
      2   0.372397D+00 -0.508875D+00  0.469046D-01 -0.394509D+01  0.236846D+01
      3  -0.241878D+01  0.391075D+00 -0.394509D+01 -0.119736D+01  0.103955D+01
                56            57            58            59            60 
      1   0.236846D+01  0.103955D+01  0.303496D+01 -0.354450D+01  0.321069D+00
      2  -0.244663D+01  0.208262D+00 -0.354450D+01 -0.220550D+01 -0.167549D+01
      3   0.208262D+00 -0.230440D+01  0.321069D+00 -0.167549D+01  0.766831D+00
                61            62            63            64            65 
      1   0.284629D+01  0.247968D+00 -0.355487D+01 -0.420324D+01 -0.383081D+01
      2   0.247968D+00 -0.240551D+01  0.415550D+00 -0.383081D+01  0.116903D+01
      3  -0.355487D+01  0.415550D+00  0.907770D+01  0.228224D+01  0.749520D+00
                66            67            68            69            70 
      1   0.228224D+01 -0.384357D+01  0.780747D+00  0.953332D+00  0.355943D+01
      2   0.749520D+00  0.780747D+00  0.284878D+01  0.144148D+01  0.165944D+01
      3  -0.146698D+01  0.953332D+00  0.144148D+01  0.513605D+00 -0.261638D+01
                71            72            73            74            75 
      1   0.165944D+01 -0.261638D+01 -0.227677D+01  0.966253D+00 -0.160511D+00
      2   0.184304D+01  0.167759D+00  0.966253D+00 -0.208856D+01  0.982298D+00
      3   0.167759D+00 -0.644609D+01 -0.160511D+00  0.982298D+00 -0.175327D+00
                76            77            78            79            80 
      1   0.555017D+00 -0.367540D+01  0.968374D+00  0.532283D+00  0.174738D+01
      2  -0.367540D+01 -0.805255D+01 -0.549233D+00  0.174738D+01 -0.225086D+00
      3   0.968374D+00 -0.549233D+00 -0.382449D+01 -0.147072D+01 -0.631181D+01
                81            82            83            84            85 
      1  -0.147072D+01 -0.574599D+01 -0.431960D+01  0.184989D+00 -0.405543D+01
      2  -0.631181D+01 -0.431960D+01 -0.377957D+01  0.173568D+00 -0.473533D+01
      3   0.367162D+01  0.184989D+00  0.173568D+00 -0.535751D+00 -0.395961D-01
                86            87            88            89            90 
      1  -0.473533D+01 -0.395961D-01  0.352832D+00  0.185039D+00  0.621916D-02
      2  -0.661309D+01  0.181818D-02  0.185039D+00  0.161121D-01  0.244978D-01
      3   0.181818D-02 -0.641275D+00  0.621916D-02  0.244978D-01  0.371704D-02
                91            92            93            94            95 
      1  -0.137099D+02  0.139838D+01  0.144572D+01  0.151610D+01 -0.176798D+01
      2   0.139838D+01 -0.857606D+00 -0.163400D+00 -0.176798D+01  0.528630D+00
      3   0.144572D+01 -0.163400D+00 -0.990864D+00 -0.328066D+00  0.208858D+00
                96            97            98            99           100 
      1  -0.328066D+00  0.171581D+01 -0.353559D+00 -0.103216D+00 -0.223831D+01
      2   0.208858D+00 -0.353559D+00  0.187239D+00  0.445291D-01  0.248439D+01
      3   0.204161D+00 -0.103216D+00  0.445291D-01  0.101269D+00  0.364018D+00
               101           102           103           104           105 
      1   0.248439D+01  0.364018D+00  0.234563D+01 -0.377173D+01 -0.384969D+00
      2  -0.269123D+01 -0.401104D+00 -0.377173D+01  0.929455D+01  0.944726D+00
      3  -0.401104D+00 -0.395787D+00 -0.384969D+00  0.944726D+00  0.873230D+00
               106           107           108           109           110 
      1   0.377780D+00 -0.553147D+00 -0.158637D+00  0.125635D+01 -0.172670D+01
      2  -0.553147D+00  0.115186D+01  0.256312D+00 -0.172670D+01  0.195952D+01
      3  -0.158637D+00  0.256312D+00  0.119171D+00 -0.146783D+00  0.308165D+00
               111           112           113           114           115 
      1  -0.146783D+00 -0.131305D+01  0.179435D+01  0.132519D+00 -0.216995D+00
      2   0.308165D+00  0.179435D+01 -0.944092D+01 -0.922632D+00  0.268000D+00
      3   0.182358D+00  0.132519D+00 -0.922632D+00 -0.832771D+00 -0.120399D-01
               116           117           118           119           120 
      1   0.268000D+00 -0.120399D-01  0.257468D+01 -0.620313D+00 -0.206419D+01
      2  -0.902523D+00 -0.140197D+00 -0.620313D+00  0.701664D+00  0.112059D+00
      3  -0.140197D+00 -0.167729D+00 -0.206419D+01  0.112059D+00  0.188523D+01
               121           122           123           124           125 
      1  -0.101376D+01  0.156805D+01  0.152511D+00 -0.531707D+01  0.540129D+00
      2   0.156805D+01 -0.367973D+00 -0.104935D+01  0.540129D+00 -0.117318D+01
      3   0.152511D+00 -0.104935D+01 -0.386520D+00  0.392650D+01 -0.713196D+00
               126           127           128           129           130 
      1   0.392650D+01 -0.813572D+01 -0.798260D+00  0.142807D+01 -0.395491D+01
      2  -0.713196D+00 -0.798260D+00  0.317705D+01 -0.353530D+00  0.326997D+01
      3  -0.969917D+01  0.142807D+01 -0.353530D+00  0.173902D+01 -0.527811D+00
               131           132           133           134           135 
      1   0.326997D+01 -0.527811D+00  0.228811D+01 -0.117155D+01  0.118632D+01
      2   0.292317D+01  0.285046D+01 -0.117155D+01  0.337671D+01  0.744159D+00
      3   0.285046D+01  0.225429D-01  0.118632D+01  0.744159D+00 -0.645646D+01
               136           137           138           139           140 
      1   0.948191D+01  0.338814D+01 -0.188605D+01  0.298094D+01  0.227654D+01
      2   0.338814D+01  0.200119D+01 -0.659514D+00  0.227654D+01  0.178360D+01
      3  -0.188605D+01 -0.659514D+00  0.133828D+01 -0.646763D+00 -0.813859D+00
               141           142           143           144           145 
      1  -0.646763D+00 -0.389805D+01 -0.137195D+01  0.220806D+01  0.160270D+01
      2  -0.813859D+00 -0.137195D+01 -0.135890D+01  0.865701D+00  0.535411D+00
      3   0.488398D+00  0.220806D+01  0.865701D+00 -0.770189D+00  0.137825D+01
               146           147           148           149           150 
      1   0.535411D+00  0.137825D+01  0.143735D+00  0.485047D+00 -0.183483D+00
      2  -0.214322D-02  0.141525D+00  0.485047D+00 -0.198631D+00  0.772092D+00
      3   0.141525D+00  0.932392D+00 -0.183483D+00  0.772092D+00 -0.399684D+00
               151           152           153           154           155 
      1   0.219506D+01  0.296882D-01  0.303900D+01  0.102651D+01  0.838712D+00
      2   0.296882D-01  0.136660D+01  0.628733D+00  0.838712D+00  0.233246D+00
      3   0.303900D+01  0.628733D+00  0.750004D+01 -0.107416D+01 -0.365107D+00
               156           157           158           159           160 
      1  -0.107416D+01  0.828441D+00  0.166344D+01 -0.645504D+00 -0.277678D+01
      2  -0.365107D+00  0.166344D+01  0.556933D+01 -0.272917D+01 -0.201380D+01
      3   0.371169D+00 -0.645504D+00 -0.272917D+01  0.235718D+01  0.143308D+01
               161           162           163           164           165 
      1  -0.201380D+01  0.143308D+01 -0.245647D+00  0.775027D+00  0.766681D+00
      2  -0.518681D+01  0.501436D+01  0.775027D+00 -0.824548D+00 -0.209852D+00
      3   0.501436D+01 -0.648711D+01  0.766681D+00 -0.209852D+00 -0.157393D+00
               166           167           168           169           170 
      1   0.130417D+01  0.121872D+01  0.179382D+00  0.104597D+01  0.322630D+00
      2   0.121872D+01  0.903529D+01  0.280020D+01  0.322630D+00  0.479395D+01
      3   0.179382D+00  0.280020D+01  0.211280D+01  0.534550D+00  0.363789D+01
               171           172           173           174           175 
      1   0.534550D+00  0.246159D+00  0.790278D-01  0.710600D+00  0.682757D+00
      2   0.363789D+01  0.790278D-01 -0.733663D+00  0.217931D+00 -0.294861D+00
      3   0.209226D+01  0.710600D+00  0.217931D+00 -0.112850D+01  0.808601D-01
               176           177           178           179           180 
      1  -0.294861D+00  0.808601D-01  0.146553D+01 -0.507363D+00  0.622400D+00
      2  -0.605788D+00  0.696005D+00 -0.507363D+00  0.148769D+01 -0.139514D+01
      3   0.696005D+00 -0.714254D-01  0.622400D+00 -0.139514D+01  0.769097D+01
               181           182           183           184           185 
      1   0.131137D+02 -0.193228D+01 -0.319131D+00  0.708317D+00  0.930959D+00
      2  -0.193228D+01  0.140943D+01 -0.735780D-01  0.930959D+00 -0.419796D+00
      3  -0.319131D+00 -0.735780D-01  0.106164D+01  0.741897D-01 -0.384339D+00
               186           187           188           189           190 
      1   0.741897D-01 -0.152022D+01  0.329457D+00  0.125059D+01  0.233333D+00
      2  -0.384339D+00  0.329457D+00 -0.769217D+00 -0.263567D+00 -0.666118D+00
      3   0.152587D+00  0.125059D+01 -0.263567D+00  0.127961D+00 -0.512355D+00
               191           192           193           194           195 
      1  -0.666118D+00 -0.512355D+00 -0.131215D+01  0.438479D+00 -0.932686D-01
      2  -0.135005D+01 -0.956723D-01  0.438479D+00 -0.834605D+01 -0.162321D+01
      3  -0.956723D-01 -0.489778D+00 -0.932686D-01 -0.162321D+01 -0.139859D+01
               196           197           198 
      1  -0.115753D+01  0.423513D+00 -0.127094D+00
      2   0.423513D+00 -0.253481D+01 -0.149963D+01
      3  -0.127094D+00 -0.149963D+01 -0.595840D+00
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.131058D+01 -0.163319D+00 -0.461044D+01  0.106451D+01  0.548734D-01
      2   0.729038D+00  0.933601D+00  0.323811D+01 -0.205334D+00 -0.674865D+00
      3  -0.636697D+01 -0.109576D+02 -0.529820D-01  0.832264D+01 -0.383138D+01
                 6             7             8             9            10 
      1  -0.183894D+01 -0.790023D+01  0.333364D+01  0.119916D+01  0.501316D+00
      2   0.792174D+01 -0.230574D+01  0.113748D+02  0.126366D+01  0.388700D+00
      3   0.203194D+00  0.104898D+01  0.188987D+01 -0.533886D+01  0.376040D+01
                11            12            13            14            15 
      1   0.443968D+00  0.724674D+00  0.113564D+01 -0.126841D+01  0.296584D+01
      2  -0.323984D+00  0.959528D+01 -0.230482D+01 -0.151271D+00 -0.152267D+01
      3  -0.908498D+01 -0.125370D+00  0.107505D+02  0.426617D+01 -0.182852D+01
                16            17            18            19            20 
      1   0.227168D+01  0.117228D+02  0.117019D+01  0.100633D+01 -0.831415D+00
      2   0.837486D+01 -0.312660D+01 -0.340436D+01  0.648857D+00 -0.411223D-02
      3   0.122630D+01 -0.185822D+00  0.198651D+01 -0.280129D+01 -0.157120D+02
                21            22            23            24            25 
      1  -0.222028D+00 -0.100721D+01  0.455377D+00 -0.321694D+01  0.368854D+01
      2  -0.804241D+00  0.799193D+00  0.174415D+01 -0.706110D+01 -0.874890D+01
      3  -0.824613D+00  0.743076D+00  0.645110D+00 -0.464815D+00  0.936870D+00
                26            27            28            29            30 
      1   0.262619D+01 -0.408317D+00 -0.164057D+01  0.192574D+01 -0.148913D+01
      2  -0.971209D+01 -0.100499D+01 -0.330927D+01 -0.126831D+01 -0.108769D+01
      3   0.976268D+00  0.544143D+01 -0.370996D+01  0.527425D+01  0.158280D+01
                31            32            33            34            35 
      1   0.191613D+01  0.322621D+00 -0.126834D+01 -0.183444D+01  0.643180D+01
      2   0.192331D+01 -0.186944D+01 -0.149187D+01 -0.146543D+02 -0.146633D+01
      3   0.992292D+01  0.203853D+02 -0.126828D+01  0.240608D+01 -0.157701D+01
                36            37            38            39            40 
      1   0.512973D+00  0.614031D+00  0.145034D+01  0.160572D+01  0.215577D+01
      2   0.153024D+01 -0.152404D+01 -0.123057D+01 -0.535674D+00 -0.107687D+01
      3   0.333097D+01 -0.837775D+01  0.105721D+02  0.143136D+01  0.960915D+01
                41            42            43            44            45 
      1  -0.281880D-02 -0.360139D+00  0.321535D+01  0.100030D+02 -0.311254D+00
      2   0.348580D+00  0.541499D+00 -0.132468D+02  0.357488D+00  0.134134D+01
      3  -0.580550D+01 -0.142235D+01 -0.291655D+00 -0.546657D+01 -0.242061D+01
                46            47            48            49            50 
      1   0.668708D+00 -0.590008D+00  0.421879D+01 -0.341156D+00 -0.106598D+01
      2  -0.290544D+01  0.198186D+01 -0.285872D+01 -0.139641D+00  0.708848D+00
      3   0.999438D+01 -0.435145D+01 -0.236251D+01  0.788002D+01 -0.645890D+01
                51            52            53            54            55 
      1  -0.374289D+01  0.406272D+01  0.111243D+01 -0.164130D+01 -0.117729D+01
      2   0.216419D+01 -0.138114D+02  0.197837D+01  0.196991D+01 -0.369851D+00
      3   0.101248D+00 -0.406613D+01  0.112582D+01 -0.510119D+01 -0.276177D+01
                56            57            58            59            60 
      1   0.212081D+01 -0.135245D+01  0.297759D+01 -0.112617D+01 -0.148446D+01
      2   0.964744D+00 -0.109826D+01  0.141637D+01 -0.606858D+01  0.101881D+01
      3  -0.232564D+01 -0.102008D+01  0.124032D+02  0.816067D+01  0.463797D+01
                61            62            63            64            65 
      1  -0.349756D+01  0.637725D+01  0.330308D+01 -0.348772D+01 -0.120832D+01
      2  -0.106892D+02  0.101887D+01  0.141064D+02  0.734770D+01  0.356914D+01
      3  -0.345150D+01  0.743540D+01  0.194588D+01  0.872933D+01 -0.134873D+02
                66            67            68            69            70 
      1   0.197863D+01 -0.191598D+01 -0.344584D+01 -0.266174D+01  0.417435D+01
      2  -0.199259D+01  0.414806D+01  0.363614D+01  0.619284D+00 -0.120523D+02
      3   0.156714D+01 -0.857350D+01 -0.603079D+01 -0.346367D+01  0.774481D+00
                71            72            73            74            75 
      1   0.203704D+01  0.647174D+01  0.651561D+00 -0.272960D+01 -0.797101D-01
      2  -0.129891D+01 -0.131679D+02 -0.134355D+01  0.983733D+00  0.204646D+01
      3  -0.453282D+01 -0.350049D+01 -0.800457D+01  0.973660D+00 -0.156919D+01
                76            77            78            79            80 
      1  -0.101814D+01  0.504751D+01  0.724156D+01  0.525891D+01  0.222504D+02
      2   0.401814D+00  0.985963D-01 -0.257099D+01 -0.532105D+01 -0.558230D+01
      3   0.138535D+02 -0.470415D+01  0.408185D+01 -0.736733D+00  0.764193D+01
                81            82            83            84            85 
      1  -0.684504D+01  0.336647D+00  0.385892D+00 -0.243212D+01 -0.115322D+00
      2   0.294197D+01 -0.682065D+00 -0.705713D+00  0.308359D+01 -0.171472D-01
      3   0.188009D+01 -0.135873D+01 -0.489169D+01  0.288516D+00 -0.345091D+01
                86            87            88            89            90 
      1  -0.369997D-01 -0.326186D+01  0.112222D+01  0.167188D+01  0.798949D-01
      2  -0.197539D+00  0.312752D+01 -0.132092D+01 -0.111751D+01 -0.435907D-01
      3  -0.107058D+02  0.115553D+00 -0.298171D+00 -0.722748D+00  0.266615D+00
                91            92            93            94            95 
      1   0.251222D-01 -0.436413D+00  0.631927D+00 -0.179996D+00  0.128278D+00
      2  -0.206500D+01  0.264621D+00  0.628110D+01  0.953823D+00 -0.480612D+00
      3   0.239101D+01 -0.545139D+01 -0.325935D+00 -0.412816D+01  0.182353D+01
                96            97            98            99           100 
      1  -0.445279D+00 -0.543524D+00  0.478989D+00 -0.115963D+00 -0.784941D-01
      2  -0.106866D+01 -0.296154D+01  0.455076D+00 -0.366702D+00 -0.456886D+00
      3   0.583089D+00 -0.678411D+00  0.693460D+00 -0.950577D-01  0.976988D+00
               101           102           103           104           105 
      1   0.243742D+00  0.160090D+01  0.689974D-01  0.468823D+00 -0.431342D+01
      2   0.618608D+00  0.138437D+01  0.363984D+00 -0.174854D+01 -0.267902D+01
      3  -0.265969D+01 -0.398577D+00 -0.978552D+00  0.152848D+02  0.147580D+01
               106           107           108           109           110 
      1  -0.299513D+00  0.166856D+01 -0.339510D+00  0.238951D+00  0.139156D-01
      2  -0.991830D+00  0.369046D+00 -0.265211D+00  0.645406D+00 -0.670990D+00
      3  -0.324092D+00  0.128467D+01 -0.849177D-01 -0.680066D+01  0.556879D+01
               111           112           113           114           115 
      1   0.131556D+01 -0.293217D+00  0.747056D+00 -0.426109D+01 -0.356902D+00
      2   0.266779D+00 -0.838863D+00  0.966252D+00 -0.348429D+00 -0.123108D+01
      3   0.513649D+00  0.830985D+01 -0.122787D+02 -0.116808D+01  0.944927D+00
               116           117           118           119           120 
      1   0.193511D+01 -0.220054D+00 -0.725075D+00 -0.149007D+01  0.867498D+00
      2   0.290113D+00 -0.770330D-01 -0.133530D+01 -0.299780D-01  0.355787D+01
      3  -0.179966D+01 -0.104468D+00 -0.650960D+00 -0.355359D+01  0.117697D+01
               121           122           123           124           125 
      1  -0.135392D+01 -0.531849D+00 -0.854896D+00  0.980865D+00  0.282109D+01
      2   0.344038D+00 -0.240292D+00 -0.102312D+01  0.174766D+01 -0.635512D+00
      3  -0.233336D+01 -0.832986D+00  0.223834D+01  0.176492D+01  0.236316D+01
               126           127           128           129           130 
      1  -0.367899D+01  0.259846D+01  0.995273D-01  0.308400D+01 -0.220644D+01
      2  -0.154530D+02  0.802927D+01 -0.210004D+01  0.617092D+01 -0.265786D+01
      3  -0.158414D+00  0.214665D+02 -0.127740D+02 -0.162018D+01 -0.200090D+01
               131           132           133           134           135 
      1   0.936795D+01 -0.272447D+00  0.284892D+00  0.484165D+01 -0.107750D+02
      2   0.714992D+01  0.406530D+00 -0.313428D+00  0.292996D+01 -0.168302D+02
      3  -0.179523D+02 -0.811514D+01 -0.887656D+00 -0.810842D+01 -0.468238D+01
               136           137           138           139           140 
      1   0.251282D+01  0.555363D+00 -0.254309D+01  0.795346D+00  0.774653D+00
      2  -0.503450D+01 -0.193727D+01  0.601462D+01 -0.186134D+01 -0.197828D+01
      3   0.493327D+01 -0.400643D+01 -0.104868D+01  0.521180D+00 -0.229123D+01
               141           142           143           144           145 
      1  -0.157672D+01 -0.274494D+01  0.891243D-01  0.117726D+01 -0.129800D+01
      2   0.196385D+01  0.415352D+01  0.191455D+01 -0.267894D+01  0.195979D+01
      3   0.131432D+01 -0.217698D+01  0.302115D+01  0.849142D+00 -0.690790D-01
               146           147           148           149           150 
      1   0.214816D+00 -0.141969D+01  0.397869D+00 -0.148869D+01 -0.168973D+00
      2  -0.225353D+00  0.309267D+01 -0.673608D+00  0.131209D+01 -0.738907D+00
      3  -0.234591D+00  0.153014D+01  0.159644D+01  0.236971D+01 -0.195439D+01
               151           152           153           154           155 
      1  -0.374126D+01  0.262514D+01 -0.903983D+01  0.220719D+01  0.333046D+00
      2   0.319265D+01  0.149551D+01  0.168101D+02  0.337855D+00 -0.154920D+00
      3   0.356704D+01 -0.511187D+01  0.219312D+01  0.365273D+01  0.359384D+00
               156           157           158           159           160 
      1  -0.842738D+00  0.138784D+01  0.378795D+01 -0.664237D+01 -0.315821D+01
      2   0.114224D+01  0.955621D-01 -0.195243D+01  0.202715D+01 -0.874923D+00
      3  -0.251177D+01  0.161968D+01 -0.107589D+01  0.777463D+00 -0.619940D+01
               161           162           163           164           165 
      1  -0.867620D+01  0.145846D+02 -0.132341D+01  0.643484D+00  0.478025D+00
      2   0.384343D+01 -0.521574D+01  0.306230D+00 -0.399407D+00  0.717609D+00
      3  -0.186187D+00 -0.116000D+01 -0.117380D+01  0.931397D-01  0.199313D+01
               166           167           168           169           170 
      1  -0.135440D+01 -0.775356D+01 -0.764254D+01 -0.147230D+01 -0.800080D+01
      2  -0.536298D+00  0.228354D+01  0.167822D+01 -0.773884D+00  0.250510D+01
      3   0.474608D+01 -0.534812D+01 -0.246161D+01  0.433322D+01 -0.407855D+01
               171           172           173           174           175 
      1  -0.669213D+01  0.110082D+01 -0.634976D+00 -0.179014D+01 -0.174996D+00
      2   0.146607D+01  0.249290D+01  0.420194D+00 -0.240878D+01  0.849059D-01
      3  -0.243513D+01 -0.383668D+00  0.160651D+01 -0.178460D+01  0.120051D+01
               176           177           178           179           180 
      1   0.113119D+01 -0.109882D+01  0.357738D+00  0.133849D+01  0.138636D+02
      2   0.169784D+01 -0.426823D+00 -0.253811D+01 -0.307217D+01  0.196842D+02
      3   0.188558D+01 -0.171269D+01 -0.169911D+01 -0.345938D+01  0.362387D+01
               181           182           183           184           185 
      1  -0.276011D+00  0.184311D+00  0.203838D+01  0.319225D+00 -0.759992D+00
      2  -0.423876D+01 -0.113699D-01  0.615441D+01  0.206663D+00 -0.113872D+01
      3  -0.184063D+02 -0.456404D+01  0.105081D+01 -0.195586D+01 -0.301803D+00
               186           187           188           189           190 
      1  -0.490716D+00  0.158680D+01  0.311279D+00  0.298154D+00 -0.114480D+01
      2   0.537720D+00  0.214215D+01 -0.388141D+00  0.315526D+00 -0.136295D+01
      3   0.124390D+01  0.147032D+01  0.198117D+01 -0.109029D+01  0.403573D+01
               191           192           193           194           195 
      1  -0.530837D+00 -0.176255D+01 -0.516275D+00 -0.555083D+01 -0.591181D+01
      2   0.703987D-01 -0.653101D+00 -0.425939D+00 -0.344541D+01 -0.307493D+01
      3   0.491293D+01  0.177240D+01  0.561937D+01  0.237188D+02  0.533701D+01
               196           197           198 
      1  -0.530013D+00 -0.230535D+01 -0.185578D+01
      2  -0.145229D+01 -0.305476D+01 -0.117185D+01
      3   0.233669D+01  0.681613D+01  0.465418D+01
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.140441D+00 -0.250210D+02 -0.152102D+01  0.275997D+02  0.685032D+01
      2  -0.395704D+01  0.173636D+02 -0.698711D+00 -0.292251D+02 -0.127419D+02
      3   0.409748D+01  0.765733D+01  0.221974D+01  0.162541D+01  0.589159D+01
      4  -0.222834D+02  0.571675D+01  0.547767D+01  0.767059D+01 -0.142699D+02
      5   0.163036D+01  0.582060D+01  0.796540D+01  0.303098D+00 -0.318816D+01
      6   0.529401D+01  0.196193D+01  0.103984D+02 -0.345861D+01  0.462913D+00
                 6             7             8             9            10 
      1   0.101899D+01  0.636157D+01  0.655640D+01  0.158648D+01 -0.135461D+02
      2   0.497871D+00 -0.461483D+01 -0.550328D+01 -0.843146D+01  0.638137D+01
      3  -0.151686D+01 -0.174673D+01 -0.105311D+01  0.684498D+01  0.716478D+01
      4  -0.417795D+01  0.478692D+01 -0.213491D+01  0.157480D+02  0.492632D+01
      5   0.166216D+02  0.235946D+02  0.181809D+02  0.229862D+01  0.106179D+02
      6   0.559400D+01  0.101609D+02  0.160110D+02 -0.201525D+01 -0.823132D+00
                11            12            13            14            15 
      1   0.280860D+01  0.753951D+01 -0.134710D+02 -0.250295D+02 -0.241445D+01
      2  -0.416129D+00 -0.383633D+01  0.121614D+02  0.264404D+02  0.395083D+01
      3  -0.239247D+01 -0.370318D+01  0.130961D+01 -0.141083D+01 -0.153638D+01
      4   0.235086D+02 -0.104493D+01 -0.282203D+02  0.892896D+01  0.351782D+01
      5  -0.161873D+01  0.203788D+02 -0.606953D+01  0.282832D+01 -0.372115D+01
      6  -0.887614D+00 -0.196309D+01  0.316420D+01 -0.815041D+00 -0.694599D+01
                16            17            18            19            20 
      1   0.104904D+02 -0.409334D+01  0.138278D+02  0.151178D+02  0.211757D+02
      2  -0.352099D+01  0.269460D+01 -0.199993D+02 -0.135121D+02 -0.150645D+02
      3  -0.696946D+01  0.139875D+01  0.617144D+01 -0.160574D+01 -0.611123D+01
      4  -0.666333D+01 -0.920969D+00 -0.182685D+01  0.127973D+02 -0.137193D+02
      5   0.364330D+02 -0.383524D+01 -0.677727D+01  0.118716D+01 -0.436363D+01
      6  -0.954628D-01  0.515034D+01 -0.175776D+01 -0.285830D+01  0.499955D+01
                21            22            23            24            25 
      1  -0.828146D+00 -0.208838D+02  0.131618D+02  0.719228D+00 -0.216381D+00
      2   0.360291D+00  0.207558D+02 -0.226653D+02 -0.400208D+01  0.207771D+01
      3   0.467855D+00  0.128001D+00  0.950350D+01  0.328285D+01 -0.186133D+01
      4  -0.393700D+01  0.939072D+01  0.389712D+01  0.244001D+01 -0.426231D+01
      5  -0.295889D+01 -0.105839D+01  0.286042D+01 -0.138955D+02  0.118030D+02
      6  -0.702716D+00  0.171260D+01 -0.504074D+01  0.796743D+01 -0.719468D+01
                26            27            28            29            30 
      1  -0.212387D+01 -0.401443D+01 -0.963214D+01 -0.272073D+02 -0.740090D+00
      2  -0.266206D+01 -0.648897D+01  0.812872D+01  0.206246D+02 -0.155825D+01
      3   0.478593D+01  0.105034D+02  0.150342D+01  0.658272D+01  0.229834D+01
      4   0.643089D+01 -0.155466D+02 -0.107060D+02 -0.744848D+01  0.128832D-01
      5  -0.154445D+02 -0.188789D+01 -0.175455D+01  0.507159D+00 -0.133664D+01
      6   0.130592D+02  0.224217D+01  0.723019D-01 -0.369451D+01  0.309037D+01
                31            32            33            34            35 
      1  -0.110688D+02 -0.827497D+01 -0.586686D+00  0.191005D+01  0.747860D+00
      2   0.233549D+00  0.795760D+01  0.296374D+00 -0.282094D+01 -0.551638D+00
      3   0.108352D+02  0.317375D+00  0.290313D+00  0.910886D+00 -0.196223D+00
      4   0.734037D+01 -0.989014D+01 -0.230074D+01 -0.549543D+00  0.138347D+01
      5  -0.260499D+01 -0.233975D+01 -0.845876D+00  0.135767D+01 -0.307544D+01
      6  -0.743760D+01 -0.164422D+01  0.323271D+01  0.217128D+01  0.106358D+02
                36            37            38            39            40 
      1  -0.125793D+02 -0.246081D+02  0.456732D+01 -0.411975D+00 -0.338824D+01
      2   0.246593D+01  0.881426D+01 -0.104687D+01  0.458008D+00  0.574091D+01
      3   0.101134D+02  0.157938D+02 -0.352045D+01 -0.460332D-01 -0.235267D+01
      4  -0.204381D+01 -0.627412D+01  0.696883D+01  0.734474D+00 -0.109042D+02
      5   0.211600D+01 -0.688819D+01 -0.270439D+00  0.118971D+01  0.357759D+00
      6  -0.132079D+01  0.629608D+00 -0.173370D+01 -0.196344D+01  0.524470D+01
                41            42            43            44            45 
      1  -0.468668D+01  0.943364D+00  0.429987D+01 -0.178745D+01 -0.878381D+01
      2   0.127813D+02  0.154362D+01 -0.779343D+00  0.179557D+01 -0.331932D+01
      3  -0.809460D+01 -0.248698D+01 -0.352053D+01 -0.812492D-02  0.121031D+02
      4   0.725634D+01  0.356141D+01 -0.170855D+01  0.407405D+01 -0.139689D+01
      5   0.257703D+01  0.219196D+00  0.386954D+01  0.100047D+01  0.553678D-02
      6   0.847540D+00 -0.694870D+00 -0.138664D+01  0.451565D+01  0.911959D+00
                46            47            48            49            50 
      1   0.797229D+01  0.121348D+02 -0.100041D+01  0.331628D+01  0.832302D+01
      2  -0.548139D+01 -0.110953D+02  0.158837D+01  0.535776D+01 -0.162470D+02
      3  -0.249091D+01 -0.103947D+01 -0.587965D+00 -0.867403D+01  0.792398D+01
      4   0.124086D+02 -0.196750D+02 -0.252652D+01  0.158267D+02  0.124571D+02
      5   0.173405D+00 -0.248349D+01 -0.629897D+01  0.166015D+01  0.580478D+00
      6  -0.420928D+01  0.289948D+01 -0.845542D+01  0.517172D+00 -0.460694D+01
                51            52            53            54            55 
      1   0.180601D+01 -0.666774D+00 -0.298702D+00 -0.162219D+02  0.184570D+02
      2  -0.361515D+01  0.170967D+01 -0.312342D+01  0.355503D+01 -0.564865D+01
      3   0.180914D+01 -0.104290D+01  0.342213D+01  0.126669D+02 -0.128084D+02
      4   0.304048D+00  0.230839D+01  0.420411D+01  0.696811D+01  0.103572D+02
      5   0.238085D+01  0.124678D+01  0.702170D+01  0.521232D+01  0.432121D+01
      6   0.828713D+01 -0.237083D+01  0.170384D+02  0.488592D+01 -0.226898D+00
                56            57            58            59            60 
      1   0.100846D+01 -0.167194D+01  0.504775D+01 -0.845525D+01  0.156160D+01
      2   0.214346D+01 -0.386088D+01 -0.343934D+00  0.447433D+00  0.126295D+01
      3  -0.315192D+01  0.553282D+01 -0.470381D+01  0.800781D+01 -0.282455D+01
      4  -0.123043D+02  0.426359D+00 -0.229446D+02 -0.632296D+01 -0.845579D+01
      5   0.129935D+01 -0.106610D+02  0.223144D+01 -0.833258D+01  0.390210D+01
      6  -0.354541D+01  0.345801D+01 -0.572722D+01  0.322499D+01 -0.250587D+01
                61            62            63            64            65 
      1  -0.120818D+02  0.184569D+01  0.490980D+01 -0.175361D+02 -0.191970D+02
      2  -0.108110D+02  0.387035D+01  0.126263D+02  0.226207D+01  0.104852D+02
      3   0.228927D+02 -0.571604D+01 -0.175361D+02  0.152740D+02  0.871186D+01
      4   0.122627D+01 -0.135341D+02  0.552935D+01 -0.232700D+02 -0.676741D+01
      5  -0.168247D+02  0.350139D+01  0.378481D+02  0.152186D+02  0.562348D+01
      6   0.637531D+01 -0.660632D+00 -0.864164D+01  0.663873D+01  0.311243D+01
                66            67            68            69            70 
      1   0.988838D+01 -0.208333D+02  0.750547D+00  0.201155D+01  0.161577D+02
      2  -0.188481D+01  0.112535D+02  0.208182D+01  0.745298D+00  0.367149D-01
      3  -0.800357D+01  0.957980D+01 -0.283236D+01 -0.275685D+01 -0.161944D+02
      4   0.714717D+01 -0.404843D+01  0.133697D+02  0.742988D+01  0.139618D+02
      5  -0.798717D+01  0.689271D+01  0.620223D+01  0.151882D+01 -0.149182D+02
      6  -0.359347D+01  0.450740D+01  0.606227D+01  0.181969D+01 -0.717374D+01
                71            72            73            74            75 
      1   0.734854D+01 -0.929618D+01 -0.641660D+01  0.106580D+02 -0.449837D+01
      2  -0.187704D+01  0.169006D+02  0.992499D+01 -0.606052D+01  0.473135D+01
      3  -0.547151D+01 -0.760443D+01 -0.350839D+01 -0.459752D+01 -0.232983D+00
      4   0.102362D+02 -0.704357D+01  0.448219D+01  0.520603D+01  0.373139D-01
      5  -0.260524D+01 -0.288366D+02 -0.153885D+01  0.100354D+01 -0.128705D+01
      6   0.355968D+01 -0.109350D+02  0.104520D+01  0.639576D+01 -0.585102D+00
                76            77            78            79            80 
      1   0.230982D+02  0.299928D+02  0.363624D+00 -0.987592D+01 -0.140153D+01
      2  -0.174608D+02 -0.322493D+02 -0.832553D+01  0.635686D+01 -0.983323D+01
      3  -0.563738D+01  0.225653D+01  0.796191D+01  0.351906D+01  0.112348D+02
      4   0.246165D+01 -0.609723D+01  0.702690D-02 -0.117472D+00  0.203087D+01
      5   0.238228D+01  0.690297D+00 -0.674602D+01 -0.162108D+01 -0.995112D+01
      6   0.511482D+01 -0.593768D+01 -0.222807D+02 -0.106427D+02 -0.411353D+02
                81            82            83            84            85 
      1   0.291338D+02  0.257021D+02  0.156999D+02 -0.294146D+00  0.103658D+02
      2  -0.273303D+02 -0.459784D+01  0.125273D+01  0.936087D-01  0.743533D+01
      3  -0.180342D+01 -0.211043D+02 -0.169526D+02  0.200538D+00 -0.178011D+02
      4  -0.755656D+01  0.383521D+02  0.342626D+02 -0.106270D+01  0.374769D+02
      5   0.814789D+01 -0.437520D+00 -0.616735D+00  0.557589D+01  0.722899D+00
      6   0.174064D+02 -0.117511D+01 -0.124016D+01  0.320180D+01 -0.280284D+00
                86            87            88            89            90 
      1   0.471837D+01  0.137248D+00 -0.181839D+01 -0.140245D+01  0.299414D+00
      2   0.174104D+02 -0.323013D+00  0.929319D+00  0.984889D+00  0.107403D+01
      3  -0.221288D+02  0.185765D+00  0.889072D+00  0.417557D+00 -0.137344D+01
      4   0.462086D+02 -0.624923D-01 -0.163308D+01 -0.784733D+00  0.228205D+01
      5   0.799170D+00  0.460679D+01  0.141193D+01  0.684339D+00 -0.394980D+00
      6  -0.564665D+00  0.521091D+01  0.104699D+01  0.144935D+01 -0.170157D+00
                91            92            93            94            95 
      1   0.102452D+03 -0.100415D+02 -0.914063D+01 -0.983602D+01  0.100532D+02
      2  -0.597231D+02  0.546906D+01  0.634767D+01  0.489458D+01 -0.490403D+01
      3  -0.427294D+02  0.457244D+01  0.279296D+01  0.494144D+01 -0.514920D+01
      4  -0.143887D+02  0.969061D+01  0.140437D+01  0.165297D+02 -0.476208D+01
      5  -0.133069D+02  0.143929D+01  0.108158D+02  0.273416D+01 -0.171376D+01
      6   0.246007D+00 -0.686316D+00 -0.680464D+00 -0.121042D+01  0.317252D+00
                96            97            98            99           100 
      1   0.153820D+01 -0.121289D+02  0.173551D+01  0.347767D+01  0.586243D+01
      2  -0.115486D+01  0.728341D+01 -0.881803D+00 -0.202594D+01  0.230647D+01
      3  -0.383342D+00  0.484544D+01 -0.853703D+00 -0.145174D+01 -0.816891D+01
      4  -0.176077D+01  0.306352D+01 -0.141794D+01 -0.102552D+01 -0.179964D+02
      5  -0.156629D+01  0.318534D+01 -0.169738D+00 -0.205008D+01 -0.212853D+01
      6   0.175883D+01 -0.316739D+00  0.681785D+00  0.490394D+00  0.179547D+01
               101           102           103           104           105 
      1  -0.447607D+01 -0.587941D+00  0.167559D+00 -0.144545D+02 -0.154105D+01
      2  -0.422801D+01  0.435901D-01 -0.103497D+02  0.352264D+02  0.237980D+01
      3   0.870409D+01  0.544351D+00  0.101821D+02 -0.207719D+02 -0.838749D+00
      4   0.216297D+02  0.271641D+01  0.251180D+02 -0.473780D+02 -0.461856D+01
      5   0.239041D+01  0.337842D+01  0.229484D+01 -0.353164D+01 -0.444768D+01
      6  -0.217218D+01 -0.231578D+01 -0.253846D+01  0.627918D+01  0.714897D+01
               106           107           108           109           110 
      1  -0.716028D+00 -0.101168D+01 -0.166880D+01 -0.433606D+01  0.810190D+01
      2  -0.598934D+00  0.301019D+01  0.284223D+01  0.657914D+01 -0.100131D+02
      3   0.131496D+01 -0.199852D+01 -0.117343D+01 -0.224308D+01  0.191116D+01
      4   0.401722D+01 -0.582814D+01 -0.223713D+01 -0.334321D+01  0.780843D+01
      5   0.145114D+01 -0.141172D+01 -0.115951D+01  0.363444D+00 -0.324373D-01
      6  -0.163146D+01  0.355758D+01  0.151235D+01  0.120384D+01 -0.223846D+01
               111           112           113           114           115 
      1   0.150600D+01  0.654957D+01 -0.369554D+02 -0.399345D+01  0.995813D+00
      2  -0.996370D+00 -0.847390D+01  0.519091D+02  0.406750D+01 -0.112378D+01
      3  -0.509632D+00  0.192434D+01 -0.149537D+02 -0.740498D-01  0.127963D+00
      4   0.318562D+00  0.599119D+01  0.295310D+01  0.524151D+00  0.362910D+00
      5   0.107141D+01 -0.559706D-01  0.178930D+01  0.358117D+00  0.496515D+00
      6  -0.178555D+01 -0.119723D+01  0.755852D+01  0.735127D+01 -0.524098D+00
               116           117           118           119           120 
      1  -0.339849D+01 -0.180270D+01  0.483360D+01 -0.837698D+00 -0.407688D+01
      2   0.420035D+01  0.239152D+01 -0.830883D+01  0.283985D+00  0.600178D+01
      3  -0.801850D+00 -0.588826D+00  0.347522D+01  0.553713D+00 -0.192490D+01
      4  -0.324757D+00 -0.161461D+01 -0.391990D+01  0.693173D+01  0.172300D+01
      5  -0.621994D+00 -0.626601D+00 -0.112087D+02  0.111999D+01  0.154455D+02
      6   0.319626D+01  0.142761D+01  0.208805D+01 -0.148714D+00 -0.174613D+01
               121           122           123           124           125 
      1  -0.388495D+00 -0.170609D+01 -0.358212D+00 -0.964477D+00 -0.914346D+00
      2  -0.550593D+00 -0.844451D+00  0.200591D+00  0.129340D+02 -0.117730D+01
      3   0.939088D+00  0.255054D+01  0.157621D+00 -0.119696D+02  0.209165D+01
      4   0.972069D+01 -0.281077D+01 -0.433903D+01  0.437347D+01 -0.571595D+01
      5   0.505594D+00 -0.424498D+01 -0.159628D+01  0.232389D+02 -0.378251D+01
      6  -0.163356D+01  0.111868D+01  0.803496D+01 -0.409927D+01  0.529682D+01
               126           127           128           129           130 
      1  -0.135206D+02 -0.630797D+02  0.954029D+01  0.465013D+01 -0.315254D+01
      2  -0.236006D+02  0.360612D+02 -0.136973D+02 -0.484455D+01 -0.446810D+01
      3   0.371213D+02  0.270185D+02  0.415701D+01  0.194416D+00  0.762064D+01
      4  -0.376694D+01  0.145960D+02  0.152486D+02 -0.360281D+01  0.217838D+02
      5  -0.403331D+02  0.509003D+01 -0.152763D+01  0.878875D+01 -0.407390D+01
      6   0.923612D+01 -0.701399D+01  0.247748D+01 -0.578216D+01  0.423061D+01
               131           132           133           134           135 
      1   0.249318D+02  0.553794D+01  0.966628D+01  0.325605D+01  0.166934D+02
      2  -0.280027D+02 -0.118455D+02 -0.170095D+01 -0.132473D+02  0.169524D-01
      3   0.307086D+01  0.630757D+01 -0.796532D+01  0.999126D+01 -0.167104D+02
      4   0.409415D+01  0.131007D+02 -0.973607D+01  0.155281D+02 -0.289984D+01
      5   0.155650D+02  0.448525D+00  0.758169D+01  0.208534D+01 -0.273283D+02
      6  -0.137876D+02 -0.210418D+00 -0.449655D+01 -0.155100D+01  0.184967D+02
               136           137           138           139           140 
      1   0.514162D+02  0.147725D+02 -0.984213D+01  0.116446D+02  0.609814D+01
      2  -0.230119D+02 -0.351642D+01  0.447825D+01 -0.127563D+01  0.276769D+01
      3  -0.284043D+02 -0.112561D+02  0.536388D+01 -0.103690D+02 -0.886583D+01
      4   0.360929D+02  0.208307D+02 -0.710105D+01  0.209402D+02  0.147457D+02
      5  -0.145232D+02 -0.466508D+01  0.110115D+02 -0.447680D+01 -0.528845D+01
      6  -0.606790D+01 -0.301675D+01  0.444031D+01 -0.322418D+01 -0.315704D+01
               141           142           143           144           145 
      1  -0.176764D+01 -0.161395D+02 -0.334134D+01  0.746771D+01  0.747688D+01
      2  -0.593757D+00  0.824808D+01 -0.358776D-01 -0.630921D+01 -0.649808D+01
      3   0.236140D+01  0.789140D+01  0.337722D+01 -0.115850D+01 -0.978795D+00
      4  -0.584503D+01 -0.128337D+02 -0.980361D+01  0.819706D+01  0.547262D+01
      5   0.344943D+01  0.156346D+02  0.587790D+01 -0.698355D+01  0.831624D+01
      6   0.332561D+01  0.708064D+01  0.398762D+01 -0.349385D+01  0.249534D+01
               146           147           148           149           150 
      1   0.362811D+01  0.475077D+01  0.410607D+00 -0.105340D+01 -0.171604D+01
      2  -0.207618D+01 -0.495044D+01  0.137037D+01 -0.130104D+01  0.245835D+01
      3  -0.155193D+01  0.199668D+00 -0.178097D+01  0.235444D+01 -0.742312D+00
      4   0.267578D+01  0.213114D+01  0.407775D+01 -0.995254D+00  0.387857D+01
      5   0.482210D+00  0.959189D+01 -0.146080D+01  0.382080D+01 -0.221491D+01
      6   0.105544D+01  0.177053D+01  0.115564D+01  0.113889D+01  0.490804D+01
               151           152           153           154           155 
      1   0.784744D+01 -0.220209D+01 -0.152248D+01  0.339532D+00  0.528402D+00
      2  -0.114356D+02  0.172952D+01 -0.193607D+02 -0.126117D+01 -0.334715D+00
      3   0.358815D+01  0.472566D+00  0.208832D+02  0.921639D+00 -0.193687D+00
      4   0.458195D+01  0.730618D+01  0.695747D+01  0.328197D+01  0.699270D+01
      5   0.191556D+02  0.361350D+01  0.358758D+02 -0.229848D+01 -0.366050D+01
      6   0.668885D+01  0.478194D+01  0.159291D+02 -0.647944D+01 -0.205213D+01
               156           157           158           159           160 
      1  -0.643314D+00 -0.495418D+01 -0.238671D+02  0.117615D+02  0.424682D+01
      2  -0.148954D+00  0.591814D+01  0.273347D+02 -0.109279D+02 -0.297594D+01
      3   0.792268D+00 -0.963964D+00 -0.346758D+01 -0.833661D+00 -0.127088D+01
      4  -0.553681D+01  0.521936D+01  0.849247D+01 -0.432215D+01 -0.909744D+01
      5   0.641891D+01 -0.240039D+01 -0.494285D+01  0.445163D+01  0.693074D+01
      6   0.196769D+01 -0.438372D+01 -0.186856D+02  0.182694D+02  0.930149D+01
               161           162           163           164           165 
      1   0.227147D+02 -0.264128D+02 -0.505376D+00  0.438847D+01  0.236222D+01
      2  -0.179526D+02  0.126105D+02  0.270152D+01 -0.503136D+01 -0.191534D+01
      3  -0.476212D+01  0.138023D+02 -0.219614D+01  0.642888D+00 -0.446873D+00
      4  -0.905972D+01  0.741964D+01  0.120364D+01  0.802150D+01  0.382757D+01
      5   0.975793D+01 -0.117320D+02  0.104036D+01  0.182076D+01  0.272196D+01
      6   0.332683D+02 -0.356740D+02  0.487409D+01 -0.142944D+01 -0.767054D+00
               166           167           168           169           170 
      1  -0.282949D+01 -0.366422D+02 -0.113067D+02  0.490023D+00 -0.198113D+02
      2   0.447468D+01  0.530987D+02  0.164440D+02  0.127932D+01  0.263081D+02
      3  -0.164519D+01 -0.164565D+02 -0.513727D+01 -0.176935D+01 -0.649681D+01
      4   0.687675D+01  0.105424D+02  0.312318D+01  0.543539D+01  0.570925D+01
      5   0.159613D+01  0.372382D+01  0.332656D+01  0.345141D+01  0.540044D+01
      6   0.173349D+01  0.221798D+02  0.163594D+02  0.395665D+01  0.259190D+02
               171           172           173           174           175 
      1  -0.164565D+02  0.385568D+01 -0.249744D+01  0.588754D+01  0.110712D+01
      2   0.153283D+02 -0.419660D+01  0.304406D+01 -0.107964D+01 -0.793560D+00
      3   0.112819D+01  0.340914D+00 -0.546621D+00 -0.480789D+01 -0.313559D+00
      4   0.434559D+01 -0.381122D+00 -0.215575D+01 -0.187246D+01 -0.712542D+00
      5   0.236937D+01  0.220464D+01  0.143884D+00 -0.439472D+00  0.584347D+00
      6   0.151108D+02 -0.183418D+01 -0.160219D+01  0.338041D+01  0.850744D-02
               176           177           178           179           180 
      1  -0.620875D+01  0.233426D+01  0.622128D+01  0.376759D+01 -0.183224D+02
      2   0.436740D+01 -0.252155D+01 -0.358478D+01 -0.262105D+01 -0.938869D+01
      3   0.184136D+01  0.187286D+00 -0.263650D+01 -0.114654D+01  0.277111D+02
      4  -0.144613D+01  0.264132D+01 -0.645614D+01  0.728789D+01 -0.295116D+01
      5   0.222533D+01 -0.461720D+00  0.762243D+01 -0.626078D+01  0.334927D+02
      6  -0.234116D+01  0.620386D+01 -0.191671D+01  0.925383D+01 -0.262083D+02
               181           182           183           184           185 
      1   0.900344D+02 -0.867831D+01 -0.352701D+01  0.572914D+01  0.452241D+01
      2  -0.463786D+02  0.105436D+01  0.159964D+01 -0.598015D+01  0.461472D+00
      3  -0.436558D+02  0.762394D+01  0.192737D+01  0.251009D+00 -0.498388D+01
      4  -0.375454D+02  0.160768D+02  0.828643D+00  0.879821D+01 -0.373766D+01
      5   0.206157D+01 -0.524659D+00  0.105359D+02  0.505936D+00 -0.174721D+01
      6   0.205844D+01  0.877336D+00 -0.407738D+01  0.361694D+00  0.127880D+01
               186           187           188           189           190 
      1  -0.909255D+00 -0.750188D+01 -0.358554D+00  0.603899D+01  0.272880D+01
      2   0.145128D+01  0.397056D+01  0.208536D+01 -0.513142D+01  0.119130D+01
      3  -0.542029D+00  0.353132D+01 -0.172680D+01 -0.907570D+00 -0.392009D+01
      4  -0.186822D+01  0.397813D+01 -0.384631D+01 -0.300894D+01 -0.200689D+01
      5   0.944611D+00  0.115904D+02 -0.176939D+01 -0.337421D+00 -0.162528D+01
      6   0.754370D+00 -0.349503D+01  0.191098D+01 -0.681880D+00  0.224715D+01
               191           192           193           194           195 
      1  -0.858200D+01 -0.244753D+01 -0.546766D+01 -0.283386D+02 -0.613062D+01
      2   0.962219D+01  0.239520D+01  0.179977D+01  0.492115D+02  0.999202D+01
      3  -0.104020D+01  0.523311D-01  0.366790D+01 -0.208729D+02 -0.386140D+01
      4  -0.940855D-01  0.138459D+01  0.894396D+01 -0.333799D+02 -0.626256D+01
      5  -0.401459D+00 -0.132182D+01 -0.570576D+00 -0.833281D+01 -0.673286D+01
      6   0.668163D+00  0.271024D+01 -0.144790D+00  0.759782D+01  0.901023D+01
               196           197           198 
      1  -0.425384D+01 -0.681780D+01 -0.789909D+01
      2   0.146482D+01  0.117971D+02  0.650868D+01
      3   0.278902D+01 -0.497929D+01  0.139040D+01
      4   0.496157D+01 -0.108200D+02 -0.452887D+01
      5   0.645181D+00 -0.634056D+01 -0.240420D+01
      6   0.417518D+00  0.947846D+01  0.473511D+01
 End of Minotr F.D. properties file   788 does not exist.
 Leave Link 1002 at Thu Jul  8 21:25:40 2021, MaxMem= 10737418240 cpu:           38173.6 elap:            2388.9
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l601.exe)
 Copying SCF densities to generalized density rwf, IOpCl= 0 IROHF=0.

 **********************************************************************

            Population analysis using the SCF density.

 **********************************************************************

 Orbital symmetries:
       Occupied  (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
       Virtual   (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A)
 The electronic state is 1-A.
 Alpha  occ. eigenvalues --  -10.44089 -10.43848 -10.43720 -10.43699 -10.43650
 Alpha  occ. eigenvalues --  -10.43624 -10.43603 -10.43476 -10.43145 -10.42552
 Alpha  occ. eigenvalues --   -1.01866  -0.95693  -0.90394  -0.86415  -0.84689
 Alpha  occ. eigenvalues --   -0.78115  -0.73604  -0.70060  -0.68634  -0.62636
 Alpha  occ. eigenvalues --   -0.58708  -0.57545  -0.55794  -0.53889  -0.53693
 Alpha  occ. eigenvalues --   -0.51363  -0.49304  -0.48865  -0.47665  -0.45227
 Alpha  occ. eigenvalues --   -0.43908  -0.43356  -0.42486  -0.41803  -0.34385
 Alpha  occ. eigenvalues --   -0.32845
 Alpha virt. eigenvalues --   -0.01059  -0.00417  -0.00335   0.00273   0.01076
 Alpha virt. eigenvalues --    0.01206   0.02182   0.02293   0.03263   0.03541
 Alpha virt. eigenvalues --    0.03989   0.05630   0.05888   0.06510   0.06764
 Alpha virt. eigenvalues --    0.07284   0.08309   0.08551   0.08719   0.09330
 Alpha virt. eigenvalues --    0.10548   0.10791   0.10877   0.11457   0.11911
 Alpha virt. eigenvalues --    0.12293   0.12708   0.12864   0.13246   0.13422
 Alpha virt. eigenvalues --    0.13616   0.13892   0.14165   0.14869   0.15087
 Alpha virt. eigenvalues --    0.15368   0.15990   0.16284   0.16566   0.17252
 Alpha virt. eigenvalues --    0.17792   0.19007   0.19483   0.20270   0.21408
 Alpha virt. eigenvalues --    0.22037   0.23341   0.24095   0.24829   0.25233
 Alpha virt. eigenvalues --    0.25683   0.26527   0.27189   0.27541   0.27816
 Alpha virt. eigenvalues --    0.28682   0.28747   0.29382   0.30101   0.30762
 Alpha virt. eigenvalues --    0.31614   0.31996   0.32389   0.32543   0.33799
 Alpha virt. eigenvalues --    0.34945   0.35179   0.36382   0.36574   0.37169
 Alpha virt. eigenvalues --    0.37331   0.38027   0.38114   0.38930   0.39608
 Alpha virt. eigenvalues --    0.40343   0.41297   0.42138   0.42547   0.43219
 Alpha virt. eigenvalues --    0.43829   0.44564   0.44736   0.45958   0.46461
 Alpha virt. eigenvalues --    0.46876   0.47102   0.48535   0.48814   0.49831
 Alpha virt. eigenvalues --    0.50170   0.50820   0.51197   0.51632   0.52629
 Alpha virt. eigenvalues --    0.52854   0.53117   0.54124   0.55090   0.56103
 Alpha virt. eigenvalues --    0.56337   0.57396   0.57959   0.58268   0.58465
 Alpha virt. eigenvalues --    0.59004   0.59367   0.59846   0.60632   0.61497
 Alpha virt. eigenvalues --    0.61960   0.62157   0.62900   0.63104   0.63208
 Alpha virt. eigenvalues --    0.64142   0.64607   0.65017   0.66271   0.66915
 Alpha virt. eigenvalues --    0.68304   0.68716   0.69028   0.69351   0.70148
 Alpha virt. eigenvalues --    0.70391   0.71209   0.72584   0.72798   0.73835
 Alpha virt. eigenvalues --    0.74827   0.75332   0.75594   0.75691   0.76640
 Alpha virt. eigenvalues --    0.77586   0.78294   0.79786   0.80376   0.80941
 Alpha virt. eigenvalues --    0.81554   0.82486   0.83127   0.83481   0.84023
 Alpha virt. eigenvalues --    0.84397   0.85516   0.86221   0.86676   0.87213
 Alpha virt. eigenvalues --    0.87927   0.90027   0.90523   0.91803   0.93020
 Alpha virt. eigenvalues --    0.94086   0.95120   0.95367   0.95866   0.98953
 Alpha virt. eigenvalues --    1.00746   1.01888   1.02127   1.03805   1.04585
 Alpha virt. eigenvalues --    1.06929   1.07945   1.08802   1.09210   1.09951
 Alpha virt. eigenvalues --    1.11796   1.12965   1.14519   1.16013   1.17812
 Alpha virt. eigenvalues --    1.19614   1.20966   1.21540   1.26148   1.27368
 Alpha virt. eigenvalues --    1.28383   1.31704   1.35800   1.37741   1.37857
 Alpha virt. eigenvalues --    1.39413   1.39995   1.41516   1.43696   1.44561
 Alpha virt. eigenvalues --    1.45685   1.46123   1.47722   1.48619   1.49306
 Alpha virt. eigenvalues --    1.50001   1.50239   1.52910   1.55147   1.57219
 Alpha virt. eigenvalues --    1.59163   1.59667   1.61122   1.62042   1.63552
 Alpha virt. eigenvalues --    1.65061   1.66836   1.67286   1.67897   1.68726
 Alpha virt. eigenvalues --    1.69773   1.70920   1.73086   1.74304   1.75765
 Alpha virt. eigenvalues --    1.76437   1.77109   1.78082   1.78760   1.81237
 Alpha virt. eigenvalues --    1.81318   1.82743   1.84128   1.84774   1.86662
 Alpha virt. eigenvalues --    1.87044   1.88273   1.90361   1.92207   1.93110
 Alpha virt. eigenvalues --    1.93541   1.94563   1.95063   1.96876   1.97554
 Alpha virt. eigenvalues --    2.00340   2.00834   2.03653   2.03992   2.05341
 Alpha virt. eigenvalues --    2.06363   2.06748   2.07982   2.09146   2.09937
 Alpha virt. eigenvalues --    2.12045   2.13350   2.14595   2.14987   2.15956
 Alpha virt. eigenvalues --    2.17909   2.19484   2.20732   2.21825   2.22816
 Alpha virt. eigenvalues --    2.25736   2.27247   2.28506   2.28956   2.29101
 Alpha virt. eigenvalues --    2.30434   2.31803   2.34478   2.37158   2.39420
 Alpha virt. eigenvalues --    2.41370   2.41843   2.44493   2.46910   2.49455
 Alpha virt. eigenvalues --    2.51518   2.53830   2.56952   2.57001   2.59206
 Alpha virt. eigenvalues --    2.60237   2.63141   2.63833   2.66478   2.69719
 Alpha virt. eigenvalues --    2.70660   2.71408   2.77053   2.78226   2.80456
 Alpha virt. eigenvalues --    2.83837   2.87656   2.89692   2.90561   2.91424
 Alpha virt. eigenvalues --    2.94734   3.01782   3.03114   3.09561   3.11591
 Alpha virt. eigenvalues --    3.16720   3.44974   3.53835   3.62734   3.77770
 Alpha virt. eigenvalues --    3.95670   4.66364
          Condensed to atoms (all electrons):
               1          2          3          4          5          6
     1  C   19.890997  -9.514245   8.921770  -7.422845   6.566448 -11.868764
     2  C   -9.514245  18.364904  -9.842754   5.544728  -7.465073   9.223398
     3  C    8.921770  -9.842754  33.121470 -15.278854   7.266346 -12.704462
     4  C   -7.422845   5.544728 -15.278854  36.009429 -17.288010   8.036721
     5  C    6.566448  -7.465073   7.266346 -17.288010  37.903056 -18.841052
     6  C  -11.868764   9.223398 -12.704462   8.036721 -18.841052  37.826357
     7  C    0.225999  -0.225013   0.265165  -7.248068   1.097812  -4.685488
     8  C    0.083854  -0.103581  -0.487815  -0.423586  -0.581324  -0.677728
     9  C   -0.334909   0.331280  -4.555299   2.926531  -5.307926   1.297327
    10  H   -1.862406   0.909379  -0.220391   0.046581  -0.149219   0.987186
    11  H    0.977387  -1.820082   0.949416  -0.199530   0.046693  -0.239480
    12  H   -0.355190   0.648983  -2.499940   1.656834  -0.057460   0.174063
    13  H    0.595822  -0.264957   0.143729  -0.322785   2.014730  -3.155989
    14  H    0.023820  -0.016210   0.062845   0.324723   0.681341   0.195562
    15  C   -0.016691  -0.024425   0.030911   0.122358  -0.527199  -0.500056
    16  H    0.006362  -0.004030   0.074500  -0.005707   0.013471  -0.114506
    17  H    0.023724  -0.027026   0.060010  -0.170904   0.346897   0.071294
    18  H   -0.037518   0.025802  -0.094145   0.170083   0.098798   0.135368
    19  H    0.031775  -0.100079   0.119739   0.236956   0.269579  -0.087250
    20  H    0.006202   0.006176  -0.003544   0.119887  -0.326168   0.108039
    21  H   -0.024025   0.010384  -0.017951  -0.020702   0.389138  -0.025270
    22  H    0.084398  -0.029807   0.015601  -0.108604  -0.143864  -0.109566
               7          8          9         10         11         12
     1  C    0.225999   0.083854  -0.334909  -1.862406   0.977387  -0.355190
     2  C   -0.225013  -0.103581   0.331280   0.909379  -1.820082   0.648983
     3  C    0.265165  -0.487815  -4.555299  -0.220391   0.949416  -2.499940
     4  C   -7.248068  -0.423586   2.926531   0.046581  -0.199530   1.656834
     5  C    1.097812  -0.581324  -5.307926  -0.149219   0.046693  -0.057460
     6  C   -4.685488  -0.677728   1.297327   0.987186  -0.239480   0.174063
     7  C   17.992331   0.045026  -0.853520   0.042804  -0.018335  -0.009133
     8  C    0.045026   7.446761  -0.033752  -0.001706   0.004187   0.016864
     9  C   -0.853520  -0.033752  12.855539  -0.022191   0.036415   0.042929
    10  H    0.042804  -0.001706  -0.022191   2.026340  -0.083871  -0.030706
    11  H   -0.018335   0.004187   0.036415  -0.083871   2.015123  -0.111066
    12  H   -0.009133   0.016864   0.042929  -0.030706  -0.111066   2.130160
    13  H    0.037192   0.105091  -0.056746  -0.116241  -0.033614   0.020140
    14  H   -1.596135   0.147688  -0.222076  -0.002137   0.000649  -0.000880
    15  C    0.639514   0.012604  -0.092999   0.009924  -0.000014   0.002807
    16  H    0.499388  -0.692026   0.286056   0.000400   0.000195   0.001083
    17  H   -0.524771  -0.092332  -0.080579   0.000630  -0.000454   0.006866
    18  H   -0.242204   0.032672  -0.117119  -0.000196  -0.000819   0.015078
    19  H    0.131746   0.133866  -0.793624   0.000963  -0.002306  -0.010409
    20  H   -0.025888  -0.070937  -0.060095   0.000152   0.000459  -0.000235
    21  H   -0.321245   0.122670   0.031714   0.000186   0.000233  -0.000173
    22  H    0.617095  -0.140526   0.027407   0.000914  -0.000540  -0.000066
              13         14         15         16         17         18
     1  C    0.595822   0.023820  -0.016691   0.006362   0.023724  -0.037518
     2  C   -0.264957  -0.016210  -0.024425  -0.004030  -0.027026   0.025802
     3  C    0.143729   0.062845   0.030911   0.074500   0.060010  -0.094145
     4  C   -0.322785   0.324723   0.122358  -0.005707  -0.170904   0.170083
     5  C    2.014730   0.681341  -0.527199   0.013471   0.346897   0.098798
     6  C   -3.155989   0.195562  -0.500056  -0.114506   0.071294   0.135368
     7  C    0.037192  -1.596135   0.639514   0.499388  -0.524771  -0.242204
     8  C    0.105091   0.147688   0.012604  -0.692026  -0.092332   0.032672
     9  C   -0.056746  -0.222076  -0.092999   0.286056  -0.080579  -0.117119
    10  H   -0.116241  -0.002137   0.009924   0.000400   0.000630  -0.000196
    11  H   -0.033614   0.000649  -0.000014   0.000195  -0.000454  -0.000819
    12  H    0.020140  -0.000880   0.002807   0.001083   0.006866   0.015078
    13  H    2.704917   0.037105   0.107752  -0.002017   0.002484  -0.001194
    14  H    0.037105   1.925774  -0.211255  -0.208340   0.126717   0.062003
    15  C    0.107752  -0.211255   5.138775   0.021281  -0.091644   0.023048
    16  H   -0.002017  -0.208340   0.021281   2.017053  -0.434407  -0.223293
    17  H    0.002484   0.126717  -0.091644  -0.434407   2.272222   0.172799
    18  H   -0.001194   0.062003   0.023048  -0.223293   0.172799   1.419991
    19  H   -0.005321  -0.002579  -0.003676   0.053050  -0.220605  -0.401269
    20  H   -0.011285   0.072716   0.402935   0.001102  -0.035779  -0.002237
    21  H    0.022358  -0.017325   0.048476  -0.014275  -0.005623   0.003362
    22  H   -0.072910  -0.114512   0.094655   0.010776   0.005081   0.000197
              19         20         21         22
     1  C    0.031775   0.006202  -0.024025   0.084398
     2  C   -0.100079   0.006176   0.010384  -0.029807
     3  C    0.119739  -0.003544  -0.017951   0.015601
     4  C    0.236956   0.119887  -0.020702  -0.108604
     5  C    0.269579  -0.326168   0.389138  -0.143864
     6  C   -0.087250   0.108039  -0.025270  -0.109566
     7  C    0.131746  -0.025888  -0.321245   0.617095
     8  C    0.133866  -0.070937   0.122670  -0.140526
     9  C   -0.793624  -0.060095   0.031714   0.027407
    10  H    0.000963   0.000152   0.000186   0.000914
    11  H   -0.002306   0.000459   0.000233  -0.000540
    12  H   -0.010409  -0.000235  -0.000173  -0.000066
    13  H   -0.005321  -0.011285   0.022358  -0.072910
    14  H   -0.002579   0.072716  -0.017325  -0.114512
    15  C   -0.003676   0.402935   0.048476   0.094655
    16  H    0.053050   0.001102  -0.014275   0.010776
    17  H   -0.220605  -0.035779  -0.005623   0.005081
    18  H   -0.401269  -0.002237   0.003362   0.000197
    19  H    1.769418   0.002199   0.001163  -0.000865
    20  H    0.002199   1.718547  -0.392809  -0.347633
    21  H    0.001163  -0.392809   1.844123  -0.486349
    22  H   -0.000865  -0.347633  -0.486349   1.925825
 Mulliken charges:
               1
     1  C   -0.001963
     2  C    0.372247
     3  C    0.673653
     4  C   -0.705234
     5  C   -0.007014
     6  C    0.954297
     7  C    0.155729
     8  C    1.154033
     9  C    0.695639
    10  H   -0.536396
    11  H   -0.520646
    12  H   -0.640546
    13  H   -0.748261
    14  H   -0.269493
    15  C    0.812918
    16  H   -0.286115
    17  H   -0.404598
    18  H   -0.039206
    19  H   -0.122473
    20  H   -0.161805
    21  H   -0.148061
    22  H   -0.226705
 Sum of Mulliken charges =  -0.00000
 Mulliken charges with hydrogens summed into heavy atoms:
               1
     1  C   -0.538359
     2  C   -0.148399
     3  C    0.033107
     4  C   -0.705234
     5  C   -0.007014
     6  C    0.206036
     7  C   -0.113764
     8  C    0.463320
     9  C    0.533960
    15  C    0.276347
 Electronic spatial extent (au):  <R**2>=           1421.9239
 Charge=             -0.0000 electrons
 Dipole moment (field-independent basis, Debye):
    X=              0.6382    Y=              0.2202    Z=             -0.1201  Tot=              0.6857
 Quadrupole moment (field-independent basis, Debye-Ang):
   XX=            -57.4053   YY=            -56.9650   ZZ=            -63.6444
   XY=              0.1326   XZ=             -1.1359   YZ=              0.6235
 Traceless Quadrupole moment (field-independent basis, Debye-Ang):
   XX=              1.9329   YY=              2.3733   ZZ=             -4.3062
   XY=              0.1326   XZ=             -1.1359   YZ=              0.6235
 Octapole moment (field-independent basis, Debye-Ang**2):
  XXX=             -8.7209  YYY=             -1.0292  ZZZ=             -0.3463  XYY=             -4.2786
  XXY=              0.1579  XXZ=              1.0933  XZZ=              7.9851  YZZ=              2.3519
  YYZ=             -0.6402  XYZ=             -0.7518
 Hexadecapole moment (field-independent basis, Debye-Ang**3):
 XXXX=          -1159.3631 YYYY=           -637.6849 ZZZZ=           -117.2427 XXXY=              4.6750
 XXXZ=            -16.2258 YYYX=              2.9740 YYYZ=              7.9348 ZZZX=              0.6466
 ZZZY=             -1.7224 XXYY=           -303.6991 XXZZ=           -237.1842 YYZZ=           -133.5031
 XXYZ=              1.2150 YYXZ=             -3.3526 ZZXY=             -0.0974
 N-N= 5.041844683919D+02 E-N=-1.907275840414D+03  KE= 3.856409444541D+02
 No NMR shielding tensors so no spin-rotation constants.
 Leave Link  601 at Thu Jul  8 21:25:41 2021, MaxMem= 10737418240 cpu:               6.6 elap:               0.6
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l716.exe)
 Electric field and nuclear coordinate derivatives read from checkpoint file.
 Rotating derivatives to standard orientation.
 Dipole        = 2.28478003D-01 8.49444388D-02-4.65017555D-02
 Polarizability= 1.37957720D+02 1.63918920D+00 1.21489626D+02
                -3.54523752D+00 1.51232014D+00 7.49665008D+01
 Translational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 2      0.0000    0.0000        0.0000    0.0000       -0.0000    0.0000
 3      0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 4     -0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 5      0.0000    0.0000        0.0000    0.0000        0.0000    0.0000
 6      0.0000    0.0000       -0.0000    0.0000       -0.0000    0.0000
 Translational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0000    0.0000        1.7419    1.7426        0.9252    0.9278
 2     -1.7419   -1.7426       -0.7449   -0.7429       -8.9832   -8.9657
 3     -0.9252   -0.9278       32.3698   32.3688        0.7376    0.7429
 4      0.7449    0.7429       -0.0000    0.0000       -0.9220   -0.9278
 5    -23.3866  -23.4030        0.9220    0.9278        1.7498    1.7426
 6     -0.7376   -0.7429       -1.7498   -1.7426        0.0000    0.0000
 Translational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.0000    0.0000       -5.2279   -5.2279        2.7835    2.7835
 2      2.2288    2.2288       -0.0000    0.0000        2.7835    2.7835
 3      2.2288    2.2288       -5.2279   -5.2279       -0.0000    0.0000
 4     -5.2279   -5.2279       -2.2288   -2.2288      -26.8972  -26.8972
 5     -2.7835   -2.7835       97.1063   97.1063        2.2288    2.2288
 6    -70.2091  -70.2091        2.7835    2.7835        5.2279    5.2279
 Rotational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.1285    0.0000       -7.0698   -6.9705       -3.6264   -3.7113
 2      7.0442    6.9705        2.9050    2.9718       35.0356   35.8629
 3      3.7181    3.7113     -129.4424 -129.4750       -2.7759   -2.9718
 4     -2.9121   -2.9718        0.0245    0.0000        3.5738    3.7113
 5     93.6625   93.6121       -3.7260   -3.7113       -6.8237   -6.9705
 6      2.7921    2.9718        7.4824    6.9705        0.1453    0.0000
 Rotational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0708    0.0000        1.9249    2.4118      -11.0460  -11.2712
 2     -2.6322   -2.4118       44.2366   44.7477       11.8429   12.2132
 3     10.9405   11.2712        8.6495    9.5289      -44.4593  -44.7477
 4    -44.8890  -44.7477        0.5025    0.0000       10.1553   11.2712
 5    -22.1401  -21.7421      -12.3609  -11.2712        0.9357    2.4118
 6     45.5594   44.7477       -3.1550   -2.4118        2.2814    0.0000
 Rotational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      3.2382    3.4199       28.6618   28.2555       16.1395   16.1867
 2    -65.9469  -65.5879       29.6867   28.7795       15.0835   16.1867
 3    -65.8969  -65.5879       28.8207   28.2555       26.8787   27.4734
 4     -0.3908   -0.5240       69.2951   69.0078        0.4728    1.1537
 5     11.9210   11.2867       18.8997   19.2577      -68.1018  -69.0078
 6    -20.6760  -20.4114      -12.9466  -11.2867       -1.1257    0.5240
 Full mass-weighted force constant matrix:
 Low frequencies ---   -3.1738   -0.0008   -0.0005    0.0003    3.5765    6.0893
 Low frequencies ---  106.3497  149.1017  211.4380
 Diagonal vibrational polarizability:
        1.3206233       0.8750057       6.3154137
 Harmonic frequencies (cm**-1), IR intensities (KM/Mole), Raman scattering
 activities (A**4/AMU), depolarization ratios for plane and unpolarized
 incident light, reduced masses (AMU), force constants (mDyne/A),
 Raman invariants Alpha2 = alpha**2, Beta2 = beta(alpha)**2 (A**4/AMU)
 ROA invariants AlphaG = alphaG', Gamma2 = beta(G')**2, Delta2 = beta(A)**2, (10**4 A**5/AMU)
 Far-From-Resonance Raman intensities (K), ROA intensites (10**4 K), CID=(ROA/Raman)*10**4
    Raman1;ROA1;CID1 =ICPu/SCPu(180), Raman2;ROA2;CID2 =ICPd/SCPd(90)
    Raman3;ROA3;CID3 =DCPI(180) RC180 = degree of circularity
 and normal coordinates:
 Incident light (cm**-1):   18796.99
                      1                      2                      3
                      A                      A                      A
 Frequencies --    106.3496               149.1015               211.4379
 Red. masses --      2.7186                 2.4375                 2.3431
 Frc consts  --      0.0181                 0.0319                 0.0617
 IR Inten    --      0.0226                 0.9817                 0.9824
 RamAct Fr= 1--      1.5839                 2.8531                 1.3812
  Dep-P Fr= 1--      0.7303                 0.7405                 0.5672
  Dep-U Fr= 1--      0.8441                 0.8509                 0.7239
 Alpha2 Fr= 1--      0.0005                 0.0005                 0.0048
 Beta2  Fr= 1--      0.2228                 0.4046                 0.1666
 AlphaG Fr= 1--     -0.0008                 0.0011                -0.0027
 Gamma2 Fr= 1--     -0.0188                 0.4797                 1.1666
 Delta2 Fr= 1--     -0.0432                 0.3645                 0.2774
 Raman1 Fr= 1--       6.336                 11.412                  5.525
 ROA1   Fr= 1--      -3.189                 57.714                120.867
 CID1   Fr= 1--      -0.503                  5.057                 21.877
 Raman2 Fr= 1--       2.674                  4.855                  2.000
 ROA2   Fr= 1--      -0.107                  8.596                 25.778
 CID2   Fr= 1--      -0.040                  1.770                 12.891
 Raman3 Fr= 1--       5.348                  9.711                  3.999
 ROA3   Fr= 1--      -3.189                 57.714                120.867
 CID3   Fr= 1--      -0.596                  5.943                 30.222
 RC180  Fr= 1--       0.688                  0.702                  0.448
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00  -0.10     0.04  -0.01   0.05     0.07  -0.04   0.12
     2   6     0.01  -0.02   0.07     0.04  -0.03   0.15     0.02  -0.04  -0.02
     3   6     0.02  -0.02   0.14     0.02  -0.01   0.04    -0.02  -0.01  -0.12
     4   6     0.01  -0.01   0.05     0.00   0.02  -0.12    -0.00   0.03  -0.07
     5   6     0.00  -0.00  -0.05     0.01   0.02  -0.15     0.01   0.04  -0.08
     6   6    -0.01   0.01  -0.16     0.03   0.01  -0.11     0.06   0.01   0.05
     7   6     0.00  -0.03  -0.02     0.02   0.03  -0.00    -0.00   0.01  -0.06
     8   6     0.04   0.02  -0.18    -0.05  -0.00   0.14     0.04   0.00  -0.06
     9   6    -0.01   0.00   0.01     0.01   0.01  -0.11     0.00   0.05   0.17
    10   1    -0.01   0.00  -0.19     0.06  -0.03   0.13     0.10  -0.07   0.26
    11   1     0.02  -0.02   0.14     0.06  -0.05   0.31     0.02  -0.06  -0.02
    12   1     0.03  -0.03   0.25     0.01  -0.02   0.11    -0.06  -0.02  -0.16
    13   1    -0.02   0.01  -0.27     0.03   0.02  -0.14     0.10   0.02   0.12
    14   1     0.06  -0.21  -0.00     0.17   0.10   0.02     0.04  -0.03  -0.05
    15   6    -0.07   0.05   0.21    -0.10  -0.03   0.04    -0.16  -0.04   0.01
    16   1    -0.05   0.01  -0.35     0.07  -0.00   0.37    -0.03   0.04  -0.17
    17   1     0.24   0.09  -0.21    -0.31  -0.05   0.19     0.21  -0.04  -0.09
    18   1    -0.13   0.07   0.03     0.15  -0.14  -0.18    -0.00   0.35   0.31
    19   1     0.06  -0.05   0.07    -0.06   0.11  -0.23    -0.00  -0.17   0.41
    20   1    -0.14   0.25   0.20    -0.35  -0.15  -0.01    -0.35  -0.07  -0.02
    21   1    -0.06  -0.00   0.26    -0.07   0.01   0.30    -0.13  -0.10   0.21
    22   1    -0.07  -0.01   0.36     0.01   0.01  -0.13    -0.14  -0.01  -0.08
                      4                      5                      6
                      A                      A                      A
 Frequencies --    238.2188               264.2644               397.4969
 Red. masses --      1.1483                 2.4856                 2.6060
 Frc consts  --      0.0384                 0.1023                 0.2426
 IR Inten    --      0.0084                 1.6566                 0.3911
 RamAct Fr= 1--      0.1036                 0.5039                 1.0606
  Dep-P Fr= 1--      0.4732                 0.7201                 0.1016
  Dep-U Fr= 1--      0.6424                 0.8373                 0.1845
 Alpha2 Fr= 1--      0.0006                 0.0003                 0.0185
 Beta2  Fr= 1--      0.0111                 0.0703                 0.0326
 AlphaG Fr= 1--      0.0025                -0.0029                 0.0070
 Gamma2 Fr= 1--      0.0229                -0.4869                -0.4043
 Delta2 Fr= 1--      0.0345                -0.0676                -0.1161
 Raman1 Fr= 1--       0.414                  2.016                  4.242
 ROA1   Fr= 1--       3.299                -48.911                -42.532
 CID1   Fr= 1--       7.961                -24.264                -10.026
 Raman2 Fr= 1--       0.133                  0.844                  0.391
 ROA2   Fr= 1--       0.273                -11.145                 -8.775
 CID2   Fr= 1--       2.055                -13.207                -22.428
 Raman3 Fr= 1--       0.266                  1.688                  0.783
 ROA3   Fr= 1--       3.299                -48.911                -42.532
 CID3   Fr= 1--      12.394                -28.980                -54.352
 RC180  Fr= 1--       0.285                  0.675                 -0.631
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.03   0.02   0.00    -0.06   0.04   0.08    -0.01   0.00   0.02
     2   6    -0.01   0.03  -0.01    -0.02   0.05   0.07    -0.02  -0.01   0.13
     3   6     0.01   0.01   0.00     0.02   0.01  -0.09    -0.04   0.01  -0.14
     4   6     0.00  -0.02   0.01    -0.00  -0.05  -0.12    -0.02   0.01  -0.01
     5   6    -0.01  -0.03   0.00    -0.02  -0.06  -0.13     0.01   0.01   0.09
     6   6    -0.03  -0.01   0.01    -0.08  -0.02  -0.08    -0.03   0.03  -0.16
     7   6    -0.00  -0.02  -0.01     0.02  -0.04  -0.03     0.03  -0.01   0.17
     8   6    -0.00  -0.01  -0.03    -0.03  -0.05   0.05     0.04   0.09  -0.03
     9   6    -0.00  -0.02   0.02    -0.02  -0.03   0.10    -0.04   0.03  -0.00
    10   1    -0.05   0.03   0.01    -0.07   0.05   0.21     0.00  -0.01   0.04
    11   1    -0.01   0.05  -0.02     0.00   0.09   0.19    -0.00  -0.03   0.28
    12   1     0.03   0.02  -0.00     0.08   0.04  -0.09    -0.06   0.02  -0.31
    13   1    -0.05  -0.02   0.02    -0.14  -0.04  -0.08    -0.05   0.04  -0.35
    14   1    -0.00  -0.03  -0.01     0.09  -0.03  -0.02    -0.01  -0.02   0.17
    15   6     0.07   0.04   0.01     0.15   0.10   0.05     0.06  -0.14  -0.01
    16   1    -0.02  -0.02  -0.07    -0.02  -0.01   0.11    -0.08   0.06  -0.28
    17   1     0.04  -0.01  -0.04    -0.05  -0.14   0.05     0.27   0.30  -0.06
    18   1    -0.02   0.02   0.03     0.05   0.18   0.21    -0.07   0.05   0.01
    19   1     0.00  -0.04   0.04    -0.09  -0.19   0.27    -0.07   0.01   0.01
    20   1    -0.34  -0.27  -0.07     0.40   0.35   0.10     0.13  -0.39   0.01
    21   1     0.09   0.41   0.45     0.12   0.11  -0.21     0.06  -0.15  -0.07
    22   1     0.53   0.03  -0.33     0.10  -0.00   0.34     0.01  -0.04  -0.22
                      7                      8                      9
                      A                      A                      A
 Frequencies --    423.4984               458.9573               519.9511
 Red. masses --      2.8403                 2.9757                 3.9080
 Frc consts  --      0.3001                 0.3693                 0.6225
 IR Inten    --      1.2983                 4.9778                 1.0822
 RamAct Fr= 1--      0.2987                 1.4592                 7.4982
  Dep-P Fr= 1--      0.7499                 0.1155                 0.1889
  Dep-U Fr= 1--      0.8571                 0.2071                 0.3177
 Alpha2 Fr= 1--      0.0000                 0.0246                 0.1049
 Beta2  Fr= 1--      0.0427                 0.0504                 0.3971
 AlphaG Fr= 1--      0.0001                 0.0165                -0.0278
 Gamma2 Fr= 1--      0.5581                -0.0314                -1.6083
 Delta2 Fr= 1--      0.0707                 0.0302                -0.3876
 Raman1 Fr= 1--       1.195                  5.837                 29.993
 ROA1   Fr= 1--      55.844                 -2.051               -166.800
 CID1   Fr= 1--      46.736                 -0.351                 -5.561
 Raman2 Fr= 1--       0.512                  0.604                  4.765
 ROA2   Fr= 1--      12.830                 -0.997                -35.498
 CID2   Fr= 1--      25.055                 -1.649                 -7.450
 Raman3 Fr= 1--       1.024                  1.209                  9.530
 ROA3   Fr= 1--      55.844                 -2.051               -166.800
 CID3   Fr= 1--      54.529                 -1.697                -17.503
 RC180  Fr= 1--       0.714                 -0.586                 -0.365
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03  -0.08   0.05     0.02   0.03   0.14     0.09   0.02  -0.15
     2   6    -0.00  -0.09   0.03     0.03   0.06  -0.04     0.22   0.04   0.14
     3   6    -0.09   0.01  -0.09     0.06   0.01  -0.10     0.11   0.09  -0.09
     4   6    -0.02   0.13   0.10     0.05  -0.12   0.23     0.03  -0.02  -0.09
     5   6    -0.07   0.10   0.08     0.04  -0.09   0.04    -0.03  -0.07   0.19
     6   6     0.02   0.06  -0.10    -0.02  -0.05  -0.12     0.07  -0.12   0.03
     7   6    -0.11  -0.04  -0.03     0.03   0.07  -0.09    -0.16  -0.02   0.02
     8   6     0.04  -0.15   0.00    -0.02   0.05   0.02    -0.14  -0.04  -0.02
     9   6     0.15   0.01  -0.00    -0.05  -0.07   0.01    -0.07   0.02   0.00
    10   1     0.08  -0.12   0.07    -0.02   0.06   0.22    -0.04   0.13  -0.34
    11   1    -0.01  -0.14   0.03     0.02   0.10  -0.18     0.23   0.01   0.28
    12   1    -0.25  -0.03  -0.26     0.12   0.07  -0.41     0.13   0.10  -0.16
    13   1     0.13   0.12  -0.29    -0.13  -0.06  -0.38     0.08  -0.10  -0.08
    14   1    -0.20  -0.07  -0.05     0.02   0.11  -0.09    -0.33  -0.04  -0.02
    15   6     0.01   0.08   0.01    -0.09   0.08  -0.02    -0.08   0.07  -0.03
    16   1     0.12  -0.25   0.07    -0.02   0.13   0.09    -0.08  -0.10   0.05
    17   1    -0.03  -0.24   0.01    -0.08  -0.02   0.02    -0.21  -0.08  -0.01
    18   1     0.19  -0.12  -0.06    -0.20  -0.31  -0.11    -0.05   0.25   0.12
    19   1     0.34   0.11  -0.09    -0.04   0.09  -0.17    -0.14  -0.16   0.20
    20   1     0.05   0.16   0.02    -0.22   0.18  -0.04    -0.06   0.07  -0.03
    21   1    -0.01   0.29  -0.02    -0.06  -0.06   0.11    -0.09   0.17  -0.05
    22   1     0.20  -0.02   0.12    -0.17   0.08   0.03    -0.00   0.04  -0.01
                     10                     11                     12
                      A                      A                      A
 Frequencies --    534.3372               593.4048               621.4727
 Red. masses --      4.2641                 3.1132                 3.2123
 Frc consts  --      0.7173                 0.6459                 0.7310
 IR Inten    --      0.5710                 1.4833                 0.8010
 RamAct Fr= 1--      4.8601                 1.4271                 2.5129
  Dep-P Fr= 1--      0.7315                 0.5218                 0.2799
  Dep-U Fr= 1--      0.8449                 0.6858                 0.4374
 Alpha2 Fr= 1--      0.0015                 0.0063                 0.0273
 Beta2  Fr= 1--      0.6844                 0.1631                 0.1832
 AlphaG Fr= 1--      0.0012                 0.0197                -0.0060
 Gamma2 Fr= 1--      0.6115                 0.4327                 0.2689
 Delta2 Fr= 1--      0.2265                 0.1608                -0.1300
 Raman1 Fr= 1--      19.440                  5.709                 10.051
 ROA1   Fr= 1--      65.950                 46.690                 21.657
 CID1   Fr= 1--       3.392                  8.179                  2.155
 Raman2 Fr= 1--       8.213                  1.957                  2.198
 ROA2   Fr= 1--      12.863                  9.099                  7.494
 CID2   Fr= 1--       1.566                  4.649                  3.409
 Raman3 Fr= 1--      16.426                  3.915                  4.397
 ROA3   Fr= 1--      65.950                 46.690                 21.657
 CID3   Fr= 1--       4.015                 11.927                  4.926
 RC180  Fr= 1--       0.690                  0.372                 -0.125
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.19  -0.10  -0.07     0.03  -0.06   0.12    -0.12  -0.10   0.06
     2   6    -0.03  -0.06   0.07     0.14   0.01  -0.16     0.04  -0.05  -0.05
     3   6     0.07  -0.12  -0.05     0.08   0.06   0.09     0.13  -0.11   0.02
     4   6     0.09  -0.03  -0.09     0.02   0.03  -0.00     0.14   0.06   0.04
     5   6    -0.04  -0.06   0.05    -0.12  -0.02  -0.12     0.00   0.00   0.04
     6   6    -0.15  -0.07   0.05    -0.02  -0.11  -0.10    -0.11   0.03  -0.02
     7   6    -0.01   0.15   0.04    -0.16   0.00   0.17     0.00  -0.06  -0.04
     8   6     0.20   0.08   0.07    -0.02   0.03   0.02    -0.11   0.06  -0.05
     9   6     0.18   0.00   0.00     0.02   0.02   0.00     0.02   0.25  -0.04
    10   1    -0.23  -0.08  -0.14    -0.05   0.01   0.39    -0.14  -0.09   0.01
    11   1     0.01   0.10   0.19     0.13   0.03  -0.20     0.06   0.16  -0.17
    12   1     0.06  -0.13  -0.02     0.05   0.02   0.27     0.06  -0.13  -0.09
    13   1    -0.17  -0.08   0.08     0.07  -0.09   0.04    -0.07   0.06  -0.16
    14   1    -0.06   0.26   0.02    -0.06   0.03   0.18    -0.01  -0.14  -0.04
    15   6    -0.11   0.17  -0.06    -0.02   0.02  -0.01     0.04  -0.08   0.03
    16   1     0.14  -0.01  -0.12    -0.11  -0.14  -0.29     0.11  -0.00   0.31
    17   1     0.37   0.14   0.04     0.25   0.23  -0.02    -0.49  -0.04   0.01
    18   1     0.29  -0.03  -0.00     0.03  -0.08  -0.04    -0.10   0.45   0.05
    19   1     0.05   0.03  -0.04    -0.02   0.09  -0.08     0.08   0.08   0.16
    20   1    -0.16   0.15  -0.07     0.23  -0.17   0.04     0.02  -0.09   0.02
    21   1    -0.10   0.07  -0.01    -0.06   0.21  -0.24     0.05  -0.10   0.04
    22   1    -0.20   0.21  -0.09     0.07   0.03  -0.11     0.03  -0.08   0.02
                     13                     14                     15
                      A                      A                      A
 Frequencies --    732.6043               751.3681               767.8037
 Red. masses --      3.2203                 2.3853                 1.5851
 Frc consts  --      1.0183                 0.7934                 0.5506
 IR Inten    --      4.0162                18.1070                37.6064
 RamAct Fr= 1--      2.9769                17.7917                 8.1844
  Dep-P Fr= 1--      0.1074                 0.0583                 0.1834
  Dep-U Fr= 1--      0.1939                 0.1102                 0.3099
 Alpha2 Fr= 1--      0.0512                 0.3445                 0.1161
 Beta2  Fr= 1--      0.0962                 0.3269                 0.4228
 AlphaG Fr= 1--      0.0316                -0.0203                -0.0004
 Gamma2 Fr= 1--     -0.6708                -0.5689                -0.1047
 Delta2 Fr= 1--     -0.2919                -0.1166                 0.0163
 Raman1 Fr= 1--      11.908                 71.167                 32.738
 ROA1   Fr= 1--     -73.735                -58.345                 -9.532
 CID1   Fr= 1--      -6.192                 -0.820                 -0.291
 Raman2 Fr= 1--       1.154                  3.922                  5.073
 ROA2   Fr= 1--     -13.763                -12.720                 -2.643
 CID2   Fr= 1--     -11.922                 -3.243                 -0.521
 Raman3 Fr= 1--       2.309                  7.845                 10.146
 ROA3   Fr= 1--     -73.735                -58.345                 -9.532
 CID3   Fr= 1--     -31.934                 -7.437                 -0.939
 RC180  Fr= 1--      -0.612                 -0.780                 -0.380
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.06  -0.05  -0.16    -0.00   0.05  -0.05    -0.00  -0.01  -0.03
     2   6     0.10  -0.02   0.10    -0.05  -0.01  -0.04    -0.01   0.02  -0.09
     3   6    -0.00   0.07  -0.14     0.10  -0.15  -0.07    -0.06   0.07  -0.01
     4   6     0.02   0.05   0.20     0.08  -0.05   0.02    -0.03   0.01  -0.00
     5   6    -0.07   0.02  -0.19     0.07   0.05   0.01    -0.01  -0.04   0.11
     6   6    -0.03  -0.06   0.10     0.01   0.19  -0.03    -0.01  -0.09  -0.07
     7   6     0.00  -0.03  -0.05    -0.07  -0.03   0.05     0.05   0.02  -0.03
     8   6    -0.02   0.05   0.01    -0.06  -0.05  -0.00     0.03   0.02  -0.03
     9   6    -0.01   0.05   0.07    -0.05  -0.04   0.02     0.03   0.03  -0.02
    10   1    -0.11  -0.00   0.12     0.20  -0.11   0.43     0.00  -0.00   0.54
    11   1     0.14  -0.01   0.34     0.03   0.08   0.46     0.05  -0.10   0.52
    12   1    -0.08   0.03  -0.11     0.23  -0.15   0.25    -0.04   0.02   0.40
    13   1     0.07  -0.07   0.49     0.07   0.18   0.33    -0.01  -0.12   0.20
    14   1     0.16  -0.02  -0.02    -0.10  -0.04   0.04    -0.08  -0.01  -0.05
    15   6     0.04  -0.07   0.03    -0.05   0.04  -0.02     0.02  -0.01   0.00
    16   1    -0.09   0.11  -0.06    -0.11  -0.09  -0.11     0.12   0.05   0.17
    17   1     0.09   0.02  -0.01     0.04  -0.01  -0.02    -0.16  -0.06   0.01
    18   1    -0.11  -0.31  -0.11    -0.09  -0.15  -0.03    -0.02   0.11   0.02
    19   1     0.09   0.32  -0.21    -0.06   0.03  -0.06     0.08  -0.03   0.06
    20   1     0.06  -0.03   0.03     0.05  -0.01   0.00    -0.10   0.04  -0.02
    21   1     0.04  -0.03   0.01    -0.07   0.16  -0.11     0.05  -0.14   0.11
    22   1     0.09  -0.10   0.07     0.03   0.03  -0.04    -0.06   0.01   0.02
                     16                     17                     18
                      A                      A                      A
 Frequencies --    814.9262               857.7579               881.8694
 Red. masses --      2.1386                 2.8230                 1.3484
 Frc consts  --      0.8368                 1.2238                 0.6178
 IR Inten    --      0.4324                 0.1904                 0.0980
 RamAct Fr= 1--      1.6435                 8.3644                 0.7524
  Dep-P Fr= 1--      0.7222                 0.0844                 0.6180
  Dep-U Fr= 1--      0.8387                 0.1557                 0.7639
 Alpha2 Fr= 1--      0.0008                 0.1521                 0.0018
 Beta2  Fr= 1--      0.2297                 0.2171                 0.0958
 AlphaG Fr= 1--      0.0005                 0.0532                 0.0047
 Gamma2 Fr= 1--      1.1246                 0.5657                -1.1355
 Delta2 Fr= 1--      1.1800                 0.3848                -0.6932
 Raman1 Fr= 1--       6.574                 33.458                  3.009
 ROA1   Fr= 1--     145.721                 66.621               -131.188
 CID1   Fr= 1--      22.166                  1.991                -43.592
 Raman2 Fr= 1--       2.757                  2.605                  1.149
 ROA2   Fr= 1--      17.550                 10.498                -21.706
 CID2   Fr= 1--       6.366                  4.030                -18.883
 Raman3 Fr= 1--       5.514                  5.209                  2.299
 ROA3   Fr= 1--     145.721                 66.621               -131.188
 CID3   Fr= 1--      26.428                 12.788                -57.065
 RC180  Fr= 1--       0.677                 -0.689                  0.528
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.05   0.08  -0.05     0.09   0.11   0.01     0.00  -0.01   0.06
     2   6    -0.11   0.02   0.06    -0.15   0.03   0.00    -0.01   0.00  -0.05
     3   6    -0.04  -0.03  -0.01    -0.02  -0.07  -0.02    -0.01   0.01  -0.10
     4   6     0.01  -0.06   0.10     0.02  -0.03  -0.02     0.00  -0.00   0.03
     5   6     0.02  -0.05  -0.11     0.04  -0.09   0.00     0.00   0.00  -0.04
     6   6     0.04  -0.07  -0.00     0.06  -0.10   0.00     0.01  -0.01   0.09
     7   6    -0.02   0.03   0.11    -0.11  -0.09  -0.07     0.01   0.02   0.03
     8   6    -0.00  -0.03  -0.07     0.02   0.07   0.08    -0.03  -0.01  -0.03
     9   6     0.08   0.06  -0.06     0.03   0.21   0.04     0.02  -0.01   0.01
    10   1     0.09   0.05   0.08     0.11   0.09  -0.08    -0.05   0.03  -0.39
    11   1    -0.14  -0.06  -0.06    -0.15  -0.09   0.10     0.04  -0.02   0.32
    12   1     0.02   0.02  -0.22     0.11  -0.03   0.13     0.06  -0.05   0.58
    13   1    -0.06  -0.14   0.24    -0.12  -0.15  -0.15    -0.06   0.03  -0.53
    14   1     0.11  -0.06   0.14    -0.16   0.01  -0.08     0.10  -0.03   0.04
    15   6    -0.04   0.07   0.01    -0.02  -0.06  -0.02    -0.00   0.02   0.01
    16   1     0.21  -0.25   0.16    -0.04  -0.05  -0.14     0.01  -0.03   0.02
    17   1    -0.31   0.05  -0.00     0.28   0.02   0.03    -0.08  -0.00  -0.02
    18   1    -0.14   0.32   0.06     0.22  -0.08  -0.09    -0.07  -0.03  -0.00
    19   1     0.28  -0.15   0.20    -0.11   0.42  -0.21     0.12   0.01   0.00
    20   1     0.13  -0.21   0.04    -0.01   0.19  -0.01     0.05  -0.11   0.02
    21   1    -0.07   0.08  -0.19    -0.04   0.19   0.01    -0.01  -0.01  -0.06
    22   1    -0.10   0.18  -0.22     0.23  -0.25   0.25    -0.06   0.08  -0.10
                     19                     20                     21
                      A                      A                      A
 Frequencies --    918.3026               935.9965               961.9110
 Red. masses --      1.9168                 1.3693                 1.2360
 Frc consts  --      0.9524                 0.7068                 0.6738
 IR Inten    --      0.1240                 0.5917                 0.0175
 RamAct Fr= 1--      1.3268                 0.2076                 0.0340
  Dep-P Fr= 1--      0.7471                 0.6014                 0.7267
  Dep-U Fr= 1--      0.8553                 0.7511                 0.8417
 Alpha2 Fr= 1--      0.0001                 0.0006                 0.0000
 Beta2  Fr= 1--      0.1891                 0.0260                 0.0048
 AlphaG Fr= 1--     -0.0008                 0.0025                -0.0013
 Gamma2 Fr= 1--      0.3523                 0.1106                 0.0626
 Delta2 Fr= 1--     -0.0305                 0.0071                -0.0306
 Raman1 Fr= 1--       5.307                  0.830                  0.136
 ROA1   Fr= 1--      32.839                 10.848                  5.032
 CID1   Fr= 1--       6.188                 13.064                 37.055
 Raman2 Fr= 1--       2.269                  0.312                  0.057
 ROA2   Fr= 1--       8.698                  2.599                  1.747
 CID2   Fr= 1--       3.833                  8.335                 30.571
 Raman3 Fr= 1--       4.539                  0.624                  0.114
 ROA3   Fr= 1--      32.839                 10.848                  5.032
 CID3   Fr= 1--       7.235                 17.394                 44.022
 RC180  Fr= 1--       0.711                  0.502                  0.683
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.01  -0.01  -0.01     0.01  -0.00   0.06    -0.01   0.01  -0.09
     2   6     0.02   0.00  -0.01     0.01  -0.00   0.07     0.01  -0.01   0.09
     3   6    -0.00   0.01  -0.01    -0.01   0.00  -0.09    -0.01   0.00  -0.05
     4   6    -0.01  -0.04   0.03     0.00  -0.00  -0.00    -0.00   0.00  -0.01
     5   6    -0.04   0.04  -0.03    -0.00  -0.00   0.03     0.00  -0.00   0.01
     6   6    -0.00   0.03   0.03    -0.01   0.00  -0.11     0.01  -0.00   0.05
     7   6    -0.07  -0.04  -0.02    -0.01  -0.00  -0.00    -0.00   0.00   0.00
     8   6     0.20   0.11   0.02     0.02   0.02  -0.02    -0.00  -0.00   0.00
     9   6    -0.05  -0.06  -0.05     0.00  -0.00   0.02     0.00  -0.00  -0.01
    10   1     0.02  -0.02  -0.00    -0.03   0.03  -0.34     0.07  -0.04   0.59
    11   1     0.03  -0.01   0.08    -0.05   0.04  -0.42    -0.07   0.04  -0.57
    12   1     0.02   0.01   0.02     0.07  -0.05   0.52     0.04  -0.03   0.37
    13   1     0.05   0.07  -0.12     0.06  -0.05   0.56    -0.04   0.03  -0.39
    14   1    -0.11  -0.11  -0.02    -0.11  -0.08  -0.02    -0.01   0.03  -0.00
    15   6    -0.05  -0.05  -0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
    16   1     0.36   0.13   0.35     0.06   0.07   0.10    -0.01  -0.02  -0.02
    17   1    -0.19   0.05   0.09    -0.09  -0.07  -0.01     0.01   0.02   0.00
    18   1    -0.28   0.15   0.04    -0.06  -0.08  -0.01     0.01   0.02   0.00
    19   1    -0.25  -0.22   0.10     0.02   0.06  -0.04    -0.00  -0.02   0.01
    20   1     0.15   0.04   0.04     0.00  -0.02   0.00    -0.02   0.02  -0.01
    21   1    -0.10   0.34  -0.14    -0.00  -0.01   0.00     0.01  -0.01   0.02
    22   1     0.28  -0.22   0.15    -0.00   0.01  -0.01    -0.00  -0.01   0.01
                     22                     23                     24
                      A                      A                      A
 Frequencies --    969.7726               982.9209              1037.2100
 Red. masses --      1.3951                 2.1838                 2.2217
 Frc consts  --      0.7730                 1.2431                 1.4082
 IR Inten    --      0.6958                 0.7782                 0.6274
 RamAct Fr= 1--      0.2042                 3.5581                19.1828
  Dep-P Fr= 1--      0.6158                 0.3181                 0.1669
  Dep-U Fr= 1--      0.7622                 0.4826                 0.2861
 Alpha2 Fr= 1--      0.0005                 0.0345                 0.2840
 Beta2  Fr= 1--      0.0259                 0.2862                 0.9147
 AlphaG Fr= 1--     -0.0057                 0.0206                -0.0451
 Gamma2 Fr= 1--     -0.0499                -1.1247                 1.2510
 Delta2 Fr= 1--      0.3275                 0.1360                -0.5190
 Raman1 Fr= 1--       0.817                 14.232                 76.731
 ROA1   Fr= 1--       5.693               -103.625                103.488
 CID1   Fr= 1--       6.971                 -7.281                  1.349
 Raman2 Fr= 1--       0.311                  3.434                 10.977
 ROA2   Fr= 1--      -3.816                -28.082                 34.176
 CID2   Fr= 1--     -12.260                 -8.177                  3.113
 Raman3 Fr= 1--       0.623                  6.869                 21.953
 ROA3   Fr= 1--       5.693               -103.625                103.488
 CID3   Fr= 1--       9.145                -15.086                  4.714
 RC180  Fr= 1--       0.524                 -0.035                 -0.428
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.01   0.02     0.02   0.01   0.00     0.07   0.10  -0.00
     2   6     0.02  -0.00   0.00    -0.04  -0.00   0.00     0.02  -0.00  -0.01
     3   6    -0.00   0.01  -0.03     0.01  -0.02  -0.01     0.03  -0.12   0.00
     4   6     0.00  -0.00   0.06     0.02  -0.00   0.02    -0.02  -0.01  -0.03
     5   6    -0.00   0.00  -0.02    -0.03   0.01  -0.01    -0.12   0.04  -0.04
     6   6    -0.01   0.02  -0.01     0.01   0.01  -0.00    -0.01  -0.01   0.02
     7   6     0.01   0.02   0.03    -0.06   0.02  -0.01    -0.10   0.13   0.02
     8   6     0.02  -0.08   0.06    -0.14   0.15  -0.00     0.06  -0.00  -0.06
     9   6    -0.05   0.03  -0.09     0.17  -0.14  -0.02    -0.01  -0.02   0.05
    10   1    -0.02   0.00  -0.11     0.06  -0.02  -0.05     0.03   0.14   0.01
    11   1     0.02   0.00   0.01    -0.04  -0.02   0.02     0.04   0.00   0.02
    12   1     0.00  -0.01   0.14     0.04  -0.01   0.01    -0.01  -0.13  -0.10
    13   1     0.02   0.01   0.10     0.04   0.01   0.03    -0.06  -0.01  -0.09
    14   1     0.02   0.44   0.01    -0.13   0.22  -0.04    -0.45   0.17  -0.05
    15   6     0.03  -0.03  -0.06     0.02  -0.08  -0.01     0.14  -0.04   0.04
    16   1     0.02  -0.39  -0.19    -0.26   0.35  -0.05     0.21  -0.13   0.14
    17   1     0.13   0.26   0.06    -0.14   0.34   0.01    -0.13  -0.20  -0.04
    18   1    -0.18   0.28   0.02     0.22   0.09   0.09    -0.14  -0.15  -0.02
    19   1    -0.04  -0.17   0.13     0.39  -0.29   0.17    -0.04   0.08  -0.07
    20   1    -0.20   0.32  -0.09    -0.05   0.15  -0.02    -0.15  -0.06  -0.01
    21   1     0.06  -0.07   0.21     0.03   0.02   0.12     0.20  -0.46   0.29
    22   1     0.04  -0.14   0.23     0.14  -0.21   0.22    -0.18   0.05   0.03
                     25                     26                     27
                      A                      A                      A
 Frequencies --   1053.0252              1102.3884              1106.3668
 Red. masses --      2.0945                 1.6201                 2.0587
 Frc consts  --      1.3684                 1.1600                 1.4847
 IR Inten    --      3.8036                 2.6229                 2.2774
 RamAct Fr= 1--     29.2894                 0.8473                 1.5143
  Dep-P Fr= 1--      0.0345                 0.6850                 0.5895
  Dep-U Fr= 1--      0.0668                 0.8130                 0.7417
 Alpha2 Fr= 1--      0.6002                 0.0010                 0.0045
 Beta2  Fr= 1--      0.3259                 0.1148                 0.1872
 AlphaG Fr= 1--      0.0457                -0.0071                 0.0234
 Gamma2 Fr= 1--     -0.8525                 0.4553                 0.3087
 Delta2 Fr= 1--     -0.9132                 0.4777                 0.4932
 Raman1 Fr= 1--     117.158                  3.389                  6.057
 ROA1   Fr= 1--    -111.061                 58.992                 45.418
 CID1   Fr= 1--      -0.948                 17.406                  7.498
 Raman2 Fr= 1--       3.910                  1.378                  2.246
 ROA2   Fr= 1--     -13.153                  7.105                  3.464
 CID2   Fr= 1--      -3.364                  5.157                  1.542
 Raman3 Fr= 1--       7.821                  2.755                  4.493
 ROA3   Fr= 1--    -111.061                 58.992                 45.418
 CID3   Fr= 1--     -14.201                 21.409                 10.109
 RC180  Fr= 1--      -0.866                  0.626                  0.483
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.07   0.15   0.00    -0.03  -0.01   0.00     0.02  -0.05  -0.01
     2   6     0.17  -0.07  -0.02     0.02  -0.00  -0.00     0.01  -0.05  -0.01
     3   6    -0.07  -0.09  -0.00    -0.00   0.01   0.03    -0.02   0.13   0.01
     4   6    -0.02   0.00   0.01    -0.03   0.00  -0.09     0.02  -0.07  -0.00
     5   6     0.01  -0.03   0.01     0.06  -0.02  -0.01     0.02  -0.07  -0.05
     6   6    -0.12   0.06   0.01     0.00   0.00   0.01    -0.06   0.11   0.03
     7   6     0.03  -0.05  -0.01     0.04  -0.01   0.10    -0.05  -0.12   0.05
     8   6    -0.01   0.01   0.02     0.00  -0.01  -0.08    -0.00   0.08   0.01
     9   6     0.02   0.00  -0.02    -0.01   0.01   0.11     0.05   0.02   0.02
    10   1    -0.06   0.27   0.03    -0.06   0.02   0.03     0.29  -0.27  -0.06
    11   1     0.15  -0.28  -0.04     0.02   0.03  -0.02    -0.05  -0.39  -0.01
    12   1    -0.50  -0.26   0.06    -0.04   0.01  -0.09     0.17   0.21  -0.03
    13   1    -0.55  -0.10   0.07    -0.06  -0.02  -0.06    -0.19   0.08  -0.01
    14   1     0.14  -0.07   0.01     0.00   0.16   0.08    -0.26  -0.21   0.01
    15   6    -0.03   0.02  -0.01    -0.04  -0.03  -0.07     0.06   0.07  -0.05
    16   1    -0.06   0.07  -0.02     0.14  -0.08   0.12     0.10  -0.11   0.04
    17   1     0.04   0.08   0.02    -0.27   0.15  -0.02    -0.06   0.09   0.02
    18   1     0.07   0.07   0.01    -0.39  -0.29  -0.05    -0.01  -0.03  -0.00
    19   1     0.07  -0.03   0.03     0.46   0.25  -0.10    -0.15   0.04  -0.03
    20   1     0.02   0.02  -0.01    -0.08   0.30  -0.08    -0.27   0.11  -0.11
    21   1    -0.04   0.10  -0.06    -0.05   0.20   0.06     0.11  -0.27   0.17
    22   1     0.01   0.01  -0.03     0.13  -0.18   0.19    -0.25   0.16  -0.04
                     28                     29                     30
                      A                      A                      A
 Frequencies --   1130.4591              1182.3228              1184.7116
 Red. masses --      2.1900                 1.2158                 1.5869
 Frc consts  --      1.6489                 1.0013                 1.3123
 IR Inten    --      0.2800                 0.3149                 0.2666
 RamAct Fr= 1--      1.6318                 5.3663                 3.3024
  Dep-P Fr= 1--      0.6562                 0.3659                 0.6017
  Dep-U Fr= 1--      0.7924                 0.5358                 0.7513
 Alpha2 Fr= 1--      0.0027                 0.0447                 0.0091
 Beta2  Fr= 1--      0.2155                 0.4792                 0.4135
 AlphaG Fr= 1--      0.0240                -0.0307                 0.0084
 Gamma2 Fr= 1--      0.4073                 0.5477                -0.4437
 Delta2 Fr= 1--      0.0417                 0.3519                -0.3079
 Raman1 Fr= 1--       6.527                 21.465                 13.210
 ROA1   Fr= 1--      40.433                 63.841                -52.448
 CID1   Fr= 1--       6.194                  2.974                 -3.970
 Raman2 Fr= 1--       2.586                  5.750                  4.962
 ROA2   Fr= 1--       9.441                 10.329                 -8.185
 CID2   Fr= 1--       3.650                  1.796                 -1.649
 Raman3 Fr= 1--       5.172                 11.501                  9.925
 ROA3   Fr= 1--      40.433                 63.841                -52.448
 CID3   Fr= 1--       7.817                  5.551                 -5.285
 RC180  Fr= 1--       0.585                  0.072                  0.503
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00  -0.04  -0.00     0.01  -0.05  -0.00     0.08  -0.01  -0.01
     2   6     0.04  -0.04  -0.01     0.02   0.07   0.00    -0.05   0.00   0.01
     3   6    -0.01   0.09   0.01    -0.06   0.00   0.01     0.05   0.01  -0.00
     4   6    -0.02  -0.10  -0.02     0.00  -0.02   0.01     0.06   0.10  -0.00
     5   6     0.06  -0.04   0.03     0.06  -0.01  -0.02    -0.08   0.03   0.01
     6   6    -0.07   0.08   0.00     0.01  -0.00   0.00    -0.07  -0.05   0.00
     7   6    -0.05   0.19  -0.08    -0.03   0.01   0.01     0.04   0.01   0.02
     8   6    -0.03  -0.01  -0.03    -0.02   0.03  -0.01     0.03  -0.06  -0.00
     9   6     0.03   0.03   0.02     0.02  -0.01   0.01    -0.06  -0.01  -0.01
    10   1     0.17  -0.18  -0.03     0.29  -0.28  -0.06     0.53  -0.38  -0.08
    11   1    -0.01  -0.28  -0.03     0.12   0.67   0.04    -0.05   0.01   0.00
    12   1     0.18   0.16   0.00    -0.47  -0.16   0.04     0.17   0.06  -0.01
    13   1    -0.29  -0.01   0.07    -0.16  -0.07   0.01    -0.51  -0.21   0.03
    14   1     0.11   0.38  -0.06    -0.10  -0.01  -0.00     0.08   0.03   0.03
    15   6    -0.02  -0.10   0.10     0.01  -0.01  -0.00    -0.01  -0.01  -0.01
    16   1     0.08  -0.33  -0.07     0.05  -0.13  -0.01    -0.12   0.33   0.04
    17   1     0.00  -0.17  -0.05    -0.03  -0.05  -0.02     0.03  -0.03   0.00
    18   1     0.05  -0.04  -0.01     0.10  -0.01   0.01    -0.12   0.01  -0.01
    19   1    -0.01   0.06  -0.03    -0.15  -0.01  -0.02     0.09  -0.02   0.01
    20   1     0.30  -0.23   0.16    -0.02   0.01  -0.01     0.02   0.05  -0.01
    21   1    -0.07   0.16  -0.14     0.01  -0.01   0.02    -0.02   0.07   0.00
    22   1     0.21  -0.13   0.01    -0.01  -0.01   0.02     0.03  -0.03   0.02
                     31                     32                     33
                      A                      A                      A
 Frequencies --   1194.1833              1217.7573              1242.5518
 Red. masses --      1.5167                 1.5827                 1.9720
 Frc consts  --      1.2743                 1.3828                 1.7939
 IR Inten    --      0.7081                 0.0174                 2.8113
 RamAct Fr= 1--      1.4934                10.8422                26.0673
  Dep-P Fr= 1--      0.5447                 0.2266                 0.0735
  Dep-U Fr= 1--      0.7052                 0.3695                 0.1369
 Alpha2 Fr= 1--      0.0059                 0.1371                 0.4867
 Beta2  Fr= 1--      0.1755                 0.6677                 0.5948
 AlphaG Fr= 1--      0.0054                -0.0561                -0.0044
 Gamma2 Fr= 1--     -0.3862                 2.3154                -1.5511
 Delta2 Fr= 1--     -0.0046                 0.7819                -0.5643
 Raman1 Fr= 1--       5.973                 43.369                104.269
 ROA1   Fr= 1--     -37.222                247.303               -166.964
 CID1   Fr= 1--      -6.231                  5.702                 -1.601
 Raman2 Fr= 1--       2.106                  8.013                  7.138
 ROA2   Fr= 1--      -9.231                 49.315                -32.712
 CID2   Fr= 1--      -4.383                  6.155                 -4.583
 Raman3 Fr= 1--       4.213                 16.025                 14.276
 ROA3   Fr= 1--     -37.222                247.303               -166.964
 CID3   Fr= 1--      -8.835                 15.432                -11.696
 RC180  Fr= 1--       0.410                 -0.261                 -0.726
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.03  -0.01   0.01     0.01  -0.02  -0.00     0.08   0.00  -0.01
     2   6     0.01  -0.02  -0.00     0.06   0.02  -0.01     0.04   0.05  -0.00
     3   6    -0.01   0.02  -0.00    -0.02  -0.02   0.00    -0.03  -0.06  -0.01
     4   6     0.00  -0.02   0.05    -0.12  -0.11  -0.00    -0.07  -0.11   0.02
     5   6     0.06   0.00  -0.06    -0.01  -0.02  -0.01    -0.16   0.03   0.05
     6   6     0.01   0.00   0.01    -0.01   0.04   0.01    -0.07   0.02   0.00
     7   6     0.03   0.07   0.13    -0.01   0.00  -0.02     0.07  -0.02   0.03
     8   6    -0.00  -0.04  -0.07     0.04  -0.02   0.07    -0.02   0.02  -0.07
     9   6    -0.03   0.02  -0.03    -0.05   0.07  -0.05     0.04   0.04   0.03
    10   1    -0.14   0.08   0.01     0.08  -0.08  -0.01     0.18  -0.08  -0.02
    11   1    -0.00  -0.12   0.00     0.11   0.26   0.01     0.06   0.13   0.01
    12   1     0.03   0.03   0.02     0.24   0.07  -0.02     0.27   0.04  -0.01
    13   1    -0.08  -0.03  -0.02     0.06   0.07  -0.01     0.29   0.15   0.00
    14   1    -0.34  -0.07   0.06    -0.24  -0.12  -0.06     0.57  -0.03   0.14
    15   6    -0.02  -0.04  -0.05     0.01   0.01   0.02    -0.02  -0.00  -0.06
    16   1    -0.08   0.33   0.09    -0.12   0.29   0.01     0.11  -0.14   0.04
    17   1     0.03  -0.46  -0.09     0.19  -0.05   0.04    -0.11  -0.02  -0.05
    18   1     0.53   0.09   0.02     0.01   0.14  -0.01     0.41  -0.02   0.02
    19   1    -0.19  -0.03   0.00     0.73   0.06   0.06    -0.22   0.08  -0.05
    20   1    -0.04   0.20  -0.05     0.01  -0.07   0.02    -0.04   0.17  -0.06
    21   1    -0.02   0.13   0.09     0.01  -0.04  -0.01    -0.00   0.05   0.05
    22   1     0.07  -0.13   0.14    -0.03   0.04  -0.04     0.05  -0.07   0.07
                     34                     35                     36
                      A                      A                      A
 Frequencies --   1297.0190              1305.9485              1324.7066
 Red. masses --      1.3692                 1.6613                 1.3799
 Frc consts  --      1.3571                 1.6694                 1.4267
 IR Inten    --      1.3353                 0.3038                 1.5608
 RamAct Fr= 1--      3.4898                 4.7706                 2.7319
  Dep-P Fr= 1--      0.2820                 0.4533                 0.2931
  Dep-U Fr= 1--      0.4399                 0.6238                 0.4533
 Alpha2 Fr= 1--      0.0377                 0.0289                 0.0286
 Beta2  Fr= 1--      0.2559                 0.4960                 0.2064
 AlphaG Fr= 1--     -0.0557                 0.0203                 0.0277
 Gamma2 Fr= 1--      1.0303                 0.1003                -0.8517
 Delta2 Fr= 1--      0.6993                -0.4712                -0.5582
 Raman1 Fr= 1--      13.959                 19.082                 10.928
 ROA1   Fr= 1--     121.283                 -5.452                -99.628
 CID1   Fr= 1--       8.688                 -0.286                 -9.117
 Raman2 Fr= 1--       3.071                  5.952                  2.477
 ROA2   Fr= 1--      19.131                  6.176                -15.975
 CID2   Fr= 1--       6.230                  1.038                 -6.449
 Raman3 Fr= 1--       6.141                 11.904                  4.954
 ROA3   Fr= 1--     121.283                 -5.452                -99.628
 CID3   Fr= 1--      19.749                 -0.458                -20.111
 RC180  Fr= 1--      -0.120                  0.248                 -0.093
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.01  -0.01   0.00    -0.04   0.04   0.01     0.03  -0.03  -0.00
     2   6     0.01  -0.04  -0.00    -0.01  -0.04  -0.00     0.01   0.04   0.00
     3   6     0.02  -0.03  -0.01     0.05   0.03  -0.01    -0.04  -0.01   0.00
     4   6    -0.08   0.07   0.03    -0.02   0.04   0.02     0.03  -0.04   0.00
     5   6     0.04   0.06  -0.00     0.00  -0.11   0.01    -0.01   0.04  -0.02
     6   6     0.04  -0.02  -0.01     0.04   0.03  -0.01    -0.04  -0.01   0.01
     7   6    -0.00  -0.00  -0.03    -0.09  -0.07  -0.01     0.08  -0.01  -0.03
     8   6     0.01   0.05  -0.00     0.08  -0.02  -0.07     0.01  -0.10  -0.02
     9   6    -0.07  -0.05   0.02    -0.09  -0.00   0.02     0.01   0.03   0.04
    10   1    -0.11   0.06   0.01     0.11  -0.08  -0.02    -0.03   0.03   0.00
    11   1     0.04   0.15   0.01     0.01   0.05   0.00    -0.00  -0.05  -0.00
    12   1     0.37   0.10  -0.03    -0.15  -0.05   0.02     0.03   0.02  -0.01
    13   1    -0.41  -0.19   0.03     0.11   0.06   0.01     0.04   0.02  -0.01
    14   1    -0.03  -0.23  -0.02     0.28   0.61   0.03    -0.52   0.15  -0.15
    15   6     0.01  -0.00  -0.00     0.02   0.03   0.03    -0.02   0.01   0.04
    16   1     0.19  -0.42  -0.03     0.06   0.27   0.13    -0.06   0.13   0.02
    17   1    -0.12   0.25   0.03    -0.18   0.15  -0.01    -0.23   0.66   0.06
    18   1     0.45  -0.02   0.05     0.47   0.02   0.05     0.18  -0.05   0.00
    19   1     0.12  -0.03   0.01     0.12   0.06  -0.02    -0.21   0.07  -0.04
    20   1    -0.02   0.02  -0.01    -0.04  -0.11   0.02     0.09  -0.05   0.06
    21   1     0.01  -0.01   0.00     0.01  -0.07  -0.05    -0.04   0.04  -0.10
    22   1    -0.02   0.01  -0.01    -0.08   0.08  -0.05     0.04   0.06  -0.12
                     37                     38                     39
                      A                      A                      A
 Frequencies --   1335.0554              1358.9384              1367.5134
 Red. masses --      1.5676                 3.2740                 1.6180
 Frc consts  --      1.6462                 3.5623                 1.7827
 IR Inten    --      2.2313                 5.1057                 4.5271
 RamAct Fr= 1--      2.4588                11.3329                 7.6748
  Dep-P Fr= 1--      0.7271                 0.0725                 0.5143
  Dep-U Fr= 1--      0.8420                 0.1352                 0.6793
 Alpha2 Fr= 1--      0.0010                 0.2121                 0.0354
 Beta2  Fr= 1--      0.3450                 0.2554                 0.8689
 AlphaG Fr= 1--      0.0129                -0.0209                 0.0478
 Gamma2 Fr= 1--      0.4920                -0.3925                 1.4553
 Delta2 Fr= 1--     -0.0994                -0.2743                 0.6753
 Raman1 Fr= 1--       9.835                 45.332                 30.699
 ROA1   Fr= 1--      44.049                -46.456                161.320
 CID1   Fr= 1--       4.479                 -1.025                  5.255
 Raman2 Fr= 1--       4.140                  3.065                 10.426
 ROA2   Fr= 1--      12.603                 -7.225                 29.525
 CID2   Fr= 1--       3.044                 -2.357                  2.832
 Raman3 Fr= 1--       8.281                  6.131                 20.852
 ROA3   Fr= 1--      44.049                -46.456                161.320
 CID3   Fr= 1--       5.319                 -7.578                  7.736
 RC180  Fr= 1--       0.684                 -0.730                  0.359
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.02  -0.06  -0.01     0.09  -0.12  -0.02     0.03  -0.01  -0.00
     2   6     0.02   0.01  -0.00    -0.01   0.17   0.01    -0.00   0.02   0.00
     3   6    -0.07  -0.03   0.01    -0.11  -0.02   0.01    -0.02  -0.02   0.00
     4   6    -0.05  -0.02  -0.00     0.21  -0.07  -0.03     0.01   0.02   0.00
     5   6     0.07   0.09   0.01     0.10   0.14   0.01    -0.02   0.04  -0.01
     6   6     0.02  -0.00  -0.00    -0.13  -0.06   0.01    -0.03  -0.02   0.00
     7   6    -0.09  -0.06   0.01    -0.13   0.00  -0.01     0.11  -0.14   0.02
     8   6     0.01  -0.04  -0.02     0.03   0.02   0.01    -0.04   0.11  -0.01
     9   6     0.09   0.02  -0.00    -0.15  -0.03   0.00    -0.02  -0.03  -0.01
    10   1    -0.26   0.17   0.04    -0.18   0.10   0.03    -0.01   0.02   0.00
    11   1     0.06   0.19   0.01    -0.12  -0.40  -0.02    -0.00  -0.00  -0.00
    12   1     0.36   0.13  -0.03    -0.18  -0.05   0.02     0.09   0.02  -0.01
    13   1    -0.36  -0.15   0.04     0.11   0.03  -0.00     0.01  -0.00  -0.01
    14   1     0.26   0.34   0.06     0.32  -0.04   0.08    -0.35   0.63  -0.11
    15   6     0.03   0.01   0.01     0.04   0.01  -0.02    -0.04   0.04   0.04
    16   1    -0.12   0.35   0.04     0.04  -0.04  -0.03     0.13  -0.26   0.00
    17   1    -0.01  -0.08  -0.02    -0.06  -0.03   0.02     0.16  -0.47  -0.08
    18   1    -0.26   0.02  -0.02     0.34  -0.04   0.01     0.00   0.04   0.02
    19   1    -0.28   0.00  -0.03     0.49   0.01   0.04     0.11  -0.01  -0.01
    20   1    -0.11  -0.03  -0.02    -0.10  -0.06  -0.04     0.07  -0.09   0.05
    21   1     0.02  -0.02  -0.02     0.06  -0.11   0.06    -0.06   0.00  -0.13
    22   1    -0.12   0.06  -0.00    -0.07  -0.01   0.09     0.06   0.06  -0.10
                     40                     41                     42
                      A                      A                      A
 Frequencies --   1413.0918              1483.8545              1491.6230
 Red. masses --      1.2311                 1.1182                 1.4232
 Frc consts  --      1.4484                 1.4506                 1.8656
 IR Inten    --      3.6476                 2.9737                 5.5882
 RamAct Fr= 1--      0.4346                12.6602                 4.2849
  Dep-P Fr= 1--      0.7174                 0.6002                 0.7253
  Dep-U Fr= 1--      0.8354                 0.7502                 0.8408
 Alpha2 Fr= 1--      0.0002                 0.0351                 0.0018
 Beta2  Fr= 1--      0.0605                 1.5829                 0.6005
 AlphaG Fr= 1--      0.0008                -0.0034                -0.0049
 Gamma2 Fr= 1--      0.1002                -2.1100                -3.3516
 Delta2 Fr= 1--     -0.0592                -1.2949                 1.3287
 Raman1 Fr= 1--       1.739                 50.641                 17.139
 ROA1   Fr= 1--       7.722               -243.995               -279.234
 CID1   Fr= 1--       4.441                 -4.818                -16.292
 Raman2 Fr= 1--       0.726                 18.994                  7.206
 ROA2   Fr= 1--       2.878                -40.281                -91.067
 CID2   Fr= 1--       3.962                 -2.121                -12.639
 Raman3 Fr= 1--       1.452                 37.989                 14.411
 ROA3   Fr= 1--       7.722               -243.995               -279.234
 CID3   Fr= 1--       5.316                 -6.423                -19.376
 RC180  Fr= 1--       0.671                  0.500                  0.682
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00   0.00   0.00    -0.00   0.01   0.00     0.09  -0.03  -0.01
     2   6    -0.00   0.01   0.00     0.01   0.01  -0.00    -0.05  -0.08  -0.00
     3   6     0.01  -0.00  -0.00    -0.02  -0.02   0.00    -0.03   0.05   0.01
     4   6     0.00  -0.00  -0.00    -0.01   0.02   0.00     0.07  -0.00  -0.01
     5   6    -0.01   0.00   0.00     0.02  -0.02  -0.00    -0.04  -0.05   0.00
     6   6    -0.00  -0.00  -0.00    -0.02  -0.01   0.00    -0.01   0.05   0.01
     7   6    -0.00   0.01  -0.01     0.00   0.00   0.00    -0.01  -0.00  -0.01
     8   6    -0.00   0.01   0.00     0.04   0.01   0.02     0.01   0.01   0.01
     9   6    -0.00  -0.00  -0.00     0.01  -0.07   0.01    -0.02   0.00  -0.00
    10   1     0.02  -0.02  -0.00     0.05  -0.04  -0.01    -0.25   0.26   0.05
    11   1    -0.01  -0.03  -0.00     0.01  -0.02  -0.00     0.01   0.34   0.02
    12   1    -0.03  -0.01   0.00     0.07   0.02  -0.01     0.01   0.07   0.00
    13   1     0.04   0.01  -0.00     0.09   0.03  -0.01    -0.06   0.05   0.01
    14   1    -0.00  -0.00  -0.01    -0.02  -0.02  -0.00     0.02   0.01  -0.00
    15   6     0.07  -0.10   0.06     0.00  -0.01  -0.00    -0.03  -0.04  -0.01
    16   1     0.03  -0.04   0.02    -0.16  -0.02  -0.35    -0.03   0.01  -0.06
    17   1     0.04  -0.03  -0.00    -0.36  -0.12   0.08    -0.06  -0.04   0.02
    18   1    -0.00   0.00  -0.00    -0.06   0.51   0.26     0.02  -0.04  -0.02
    19   1     0.03  -0.01   0.01    -0.02   0.36  -0.44     0.06  -0.02   0.03
    20   1    -0.35   0.45  -0.03     0.05   0.00   0.01     0.49   0.31   0.09
    21   1    -0.05   0.47  -0.32     0.00   0.06   0.06     0.03   0.04   0.45
    22   1    -0.36   0.22  -0.36    -0.06   0.01  -0.00    -0.08   0.14  -0.34
                     43                     44                     45
                      A                      A                      A
 Frequencies --   1499.0883              1499.5237              1503.0984
 Red. masses --      1.1196                 1.3717                 1.1064
 Frc consts  --      1.4825                 1.8172                 1.4727
 IR Inten    --      2.6461                 2.2977                 9.0771
 RamAct Fr= 1--      6.9286                 5.3734                 6.1017
  Dep-P Fr= 1--      0.2529                 0.7191                 0.7449
  Dep-U Fr= 1--      0.4037                 0.8366                 0.8538
 Alpha2 Fr= 1--      0.0815                 0.0029                 0.0005
 Beta2  Fr= 1--      0.4662                 0.7493                 0.8683
 AlphaG Fr= 1--     -0.0705                 0.0020                -0.0010
 Gamma2 Fr= 1--      0.0377                 5.0219                -1.6490
 Delta2 Fr= 1--      0.7817                 0.3023                -0.8750
 Raman1 Fr= 1--      27.714                 21.494                 24.407
 ROA1   Fr= 1--      28.635                491.780               -186.304
 CID1   Fr= 1--       1.033                 22.880                 -7.633
 Raman2 Fr= 1--       5.594                  8.991                 10.419
 ROA2   Fr= 1--      -5.348                118.108                -32.576
 CID2   Fr= 1--      -0.956                 13.136                 -3.126
 Raman3 Fr= 1--      11.188                 17.982                 20.839
 ROA3   Fr= 1--      28.635                491.780               -186.304
 CID3   Fr= 1--       2.559                 27.348                 -8.940
 RC180  Fr= 1--      -0.193                  0.673                  0.708
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03  -0.01  -0.00    -0.08   0.01   0.01    -0.03   0.01   0.00
     2   6    -0.02  -0.02   0.00     0.04   0.08   0.00     0.02   0.02  -0.00
     3   6    -0.01   0.01   0.00     0.03  -0.04  -0.01    -0.00  -0.02  -0.00
     4   6     0.03   0.00  -0.00    -0.06  -0.01   0.01    -0.02   0.01   0.00
     5   6    -0.00  -0.02  -0.00     0.03   0.05   0.00     0.03   0.01  -0.00
     6   6    -0.01   0.02   0.00     0.03  -0.04  -0.01    -0.00  -0.02  -0.00
     7   6    -0.02   0.02   0.01    -0.03  -0.03  -0.01    -0.02  -0.00   0.01
     8   6    -0.05  -0.02  -0.02    -0.03  -0.00  -0.01     0.04   0.01   0.01
     9   6    -0.01  -0.04   0.01     0.02  -0.01  -0.00     0.01   0.02  -0.00
    10   1    -0.08   0.08   0.02     0.17  -0.21  -0.03     0.09  -0.08  -0.02
    11   1     0.00   0.10   0.01    -0.03  -0.33  -0.02     0.01  -0.09  -0.01
    12   1     0.00   0.02   0.00    -0.06  -0.08   0.00     0.03  -0.01  -0.00
    13   1    -0.03   0.01   0.00    -0.01  -0.06  -0.00     0.03  -0.01  -0.01
    14   1     0.04  -0.06   0.03     0.03   0.05  -0.00     0.04  -0.01   0.03
    15   6    -0.01   0.01   0.02    -0.02  -0.02  -0.02    -0.03   0.00   0.03
    16   1     0.16   0.03   0.38     0.12   0.02   0.26    -0.13   0.02  -0.27
    17   1     0.38   0.15  -0.08     0.27   0.10  -0.05    -0.28  -0.13   0.06
    18   1    -0.02   0.30   0.15    -0.02   0.11   0.05    -0.00  -0.16  -0.08
    19   1     0.02   0.22  -0.27    -0.02   0.06  -0.09    -0.02  -0.12   0.15
    20   1    -0.15   0.20  -0.02     0.46   0.22   0.08    -0.00   0.40   0.02
    21   1    -0.01  -0.32  -0.24     0.04   0.04   0.46     0.00  -0.42  -0.14
    22   1     0.36  -0.04  -0.16    -0.12   0.12  -0.26     0.45   0.03  -0.39
                     46                     47                     48
                      A                      A                      A
 Frequencies --   1515.4996              1628.0046              1650.5991
 Red. masses --      2.3931                 6.2034                 6.3481
 Frc consts  --      3.2383                 9.6871                10.1900
 IR Inten    --     16.8126                 0.4329                 1.1794
 RamAct Fr= 1--      1.2762                13.5444                21.1520
  Dep-P Fr= 1--      0.4995                 0.6396                 0.7434
  Dep-U Fr= 1--      0.6662                 0.7802                 0.8528
 Alpha2 Fr= 1--      0.0063                 0.0270                 0.0024
 Beta2  Fr= 1--      0.1417                 1.7611                 3.0065
 AlphaG Fr= 1--     -0.0102                -0.0261                 0.0078
 Gamma2 Fr= 1--      0.2764                 0.1667                 0.0511
 Delta2 Fr= 1--      0.0049                -0.6235                 0.0481
 Raman1 Fr= 1--       5.105                 54.178                 84.608
 ROA1   Fr= 1--      26.693                 -3.953                  6.440
 CID1   Fr= 1--       5.229                 -0.073                  0.076
 Raman2 Fr= 1--       1.700                 21.134                 36.078
 ROA2   Fr= 1--       6.594                  8.987                  0.841
 CID2   Fr= 1--       3.878                  0.425                  0.023
 Raman3 Fr= 1--       3.401                 42.267                 72.157
 ROA3   Fr= 1--      26.693                 -3.953                  6.440
 CID3   Fr= 1--       7.849                 -0.094                  0.089
 RC180  Fr= 1--       0.332                  0.560                  0.706
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.01   0.07   0.00     0.18  -0.28  -0.04     0.20  -0.01  -0.02
     2   6     0.07  -0.03  -0.01    -0.03   0.34   0.03    -0.14  -0.12   0.01
     3   6    -0.15  -0.07   0.01     0.09  -0.14  -0.02     0.33   0.11  -0.03
     4   6     0.02   0.17   0.01    -0.19   0.23   0.04    -0.29  -0.03   0.03
     5   6     0.13  -0.10  -0.02    -0.00  -0.31  -0.02     0.23   0.16  -0.01
     6   6    -0.15  -0.06   0.01    -0.01   0.17   0.01    -0.32  -0.13   0.03
     7   6    -0.03   0.03   0.00     0.01   0.03   0.00    -0.03  -0.02   0.00
     8   6    -0.02  -0.01  -0.01     0.02   0.00  -0.00     0.00  -0.01  -0.00
     9   6    -0.00  -0.02  -0.01     0.03  -0.01  -0.01     0.04   0.01  -0.00
    10   1     0.24  -0.09  -0.03    -0.39   0.18   0.06    -0.05   0.21   0.02
    11   1     0.12   0.17  -0.00    -0.17  -0.42  -0.01    -0.11   0.18   0.02
    12   1     0.50   0.19  -0.04    -0.02  -0.20  -0.01    -0.41  -0.18   0.03
    13   1     0.52   0.19  -0.04    -0.18   0.12   0.03     0.43   0.15  -0.03
    14   1    -0.04  -0.04  -0.00    -0.04  -0.04  -0.01    -0.02   0.02  -0.00
    15   6    -0.00  -0.01  -0.01    -0.01  -0.00   0.00     0.00   0.01  -0.00
    16   1     0.08   0.01   0.17     0.02   0.01   0.00    -0.01   0.03   0.00
    17   1     0.17   0.07  -0.03    -0.01  -0.00   0.00    -0.01   0.03   0.00
    18   1    -0.06  -0.14  -0.06    -0.05  -0.07  -0.04    -0.00   0.02   0.01
    19   1    -0.11  -0.14   0.11    -0.14  -0.09   0.07    -0.08  -0.00  -0.01
    20   1     0.07  -0.02   0.01    -0.01  -0.02   0.00     0.03   0.01   0.00
    21   1     0.00   0.06   0.09    -0.01   0.02  -0.04     0.01  -0.04   0.05
    22   1    -0.07   0.01   0.02     0.03  -0.02   0.03    -0.01   0.02  -0.02
                     49                     50                     51
                      A                      A                      A
 Frequencies --   2975.1996              3010.4162              3027.1549
 Red. masses --      1.0817                 1.0712                 1.0386
 Frc consts  --      5.6412                 5.7196                 5.6073
 IR Inten    --     22.0783                29.9334                13.4248
 RamAct Fr= 1--    194.6223               203.6202               117.5007
  Dep-P Fr= 1--      0.1922                 0.1626                 0.0330
  Dep-U Fr= 1--      0.3224                 0.2797                 0.0638
 Alpha2 Fr= 1--      2.6980                 3.0481                 2.4167
 Beta2  Fr= 1--     10.4588                 9.4934                 1.2497
 AlphaG Fr= 1--      0.0253                -0.0045                -0.0142
 Gamma2 Fr= 1--      6.0132                -6.5681                 4.5969
 Delta2 Fr= 1--      1.6650                 5.3909                 3.7485
 Raman1 Fr= 1--     778.489                814.481                470.003
 ROA1   Fr= 1--     630.552               -458.032                561.254
 CID1   Fr= 1--       0.810                 -0.562                  1.194
 Raman2 Fr= 1--     125.506                113.920                 14.996
 ROA2   Fr= 1--     130.998               -200.763                 80.338
 CID2   Fr= 1--       1.044                 -1.762                  5.357
 Raman3 Fr= 1--     251.011                227.841                 29.992
 ROA3   Fr= 1--     630.552               -458.032                561.254
 CID3   Fr= 1--       2.512                 -2.010                 18.714
 RC180  Fr= 1--      -0.355                 -0.441                 -0.872
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00  -0.00  -0.00     0.00  -0.00  -0.00    -0.00  -0.00   0.00
     2   6     0.00   0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00  -0.00
     3   6     0.00  -0.00  -0.00    -0.00  -0.00   0.00     0.00   0.00   0.00
     4   6     0.00   0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
     5   6     0.00   0.00  -0.00     0.00  -0.00  -0.00     0.00   0.00  -0.00
     6   6    -0.00  -0.00   0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
     7   6     0.02  -0.00  -0.08    -0.00   0.00   0.00    -0.00  -0.00   0.00
     8   6    -0.00  -0.00   0.01    -0.00  -0.00   0.01     0.01   0.00   0.02
     9   6    -0.00   0.00  -0.00     0.00   0.05  -0.06     0.00  -0.01   0.00
    10   1    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00    -0.00   0.00  -0.00
    11   1    -0.00   0.00  -0.00    -0.00   0.00   0.00    -0.00  -0.00   0.00
    12   1    -0.00   0.00   0.00    -0.00   0.01   0.00     0.00  -0.00  -0.00
    13   1     0.00  -0.00  -0.00     0.00  -0.00  -0.00    -0.00   0.01   0.00
    14   1    -0.19   0.05   0.96     0.01  -0.00  -0.04     0.00   0.00  -0.02
    15   6    -0.00   0.00   0.01    -0.00   0.00  -0.00    -0.02   0.03  -0.03
    16   1     0.04   0.01  -0.02     0.04   0.02  -0.02    -0.11  -0.05   0.07
    17   1    -0.02   0.01  -0.11    -0.03   0.01  -0.14    -0.05   0.02  -0.32
    18   1    -0.00  -0.01   0.02    -0.04  -0.39   0.87     0.00   0.02  -0.06
    19   1    -0.00   0.00   0.00     0.02  -0.14  -0.16    -0.00   0.05   0.05
    20   1     0.02  -0.00  -0.08    -0.01   0.00   0.03    -0.12   0.01   0.57
    21   1     0.03   0.01  -0.00     0.02   0.00  -0.00     0.53   0.06  -0.07
    22   1    -0.01  -0.03  -0.01    -0.00  -0.01  -0.01    -0.14  -0.42  -0.19
                     52                     53                     54
                      A                      A                      A
 Frequencies --   3032.3421              3072.4018              3087.7679
 Red. masses --      1.0614                 1.0903                 1.1012
 Frc consts  --      5.7504                 6.0640                 6.1862
 IR Inten    --     48.5007                32.5621                 3.5992
 RamAct Fr= 1--    142.5600               158.6847                53.5165
  Dep-P Fr= 1--      0.0853                 0.2244                 0.6233
  Dep-U Fr= 1--      0.1573                 0.3665                 0.7680
 Alpha2 Fr= 1--      2.5868                 2.0184                 0.1237
 Beta2  Fr= 1--      3.7364                 9.6936                 6.8498
 AlphaG Fr= 1--      0.1696                -1.9392                 0.0611
 Gamma2 Fr= 1--     -6.9346               -14.2242               -53.0709
 Delta2 Fr= 1--     -9.0554                -8.6748               -36.8522
 Raman1 Fr= 1--     570.240                634.739                214.066
 ROA1   Fr= 1--    -955.494              -1643.117              -6274.071
 CID1   Fr= 1--      -1.676                 -2.589                -29.309
 Raman2 Fr= 1--      44.837                116.324                 82.198
 ROA2   Fr= 1--     -93.986               -271.982               -978.883
 CID2   Fr= 1--      -2.096                 -2.338                -11.909
 Raman3 Fr= 1--      89.673                232.647                164.395
 ROA3   Fr= 1--    -955.494              -1643.117              -6274.071
 CID3   Fr= 1--     -10.655                 -7.063                -38.165
 RC180  Fr= 1--      -0.685                 -0.267                  0.536
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00  -0.00    -0.00   0.00   0.00    -0.00   0.00   0.00
     2   6    -0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00  -0.00  -0.00
     3   6    -0.00  -0.00  -0.00    -0.00   0.00   0.00     0.00   0.00  -0.00
     4   6     0.00   0.00   0.00     0.00   0.00  -0.00     0.00   0.00   0.00
     5   6     0.00   0.00  -0.00     0.00   0.00  -0.00     0.00   0.00   0.00
     6   6     0.00  -0.00  -0.00     0.00  -0.00  -0.00     0.00  -0.00  -0.00
     7   6     0.00  -0.00  -0.01    -0.00   0.00   0.00     0.00   0.00  -0.00
     8   6    -0.03  -0.01  -0.05    -0.02  -0.01   0.00    -0.04  -0.02   0.05
     9   6    -0.00   0.01   0.01     0.01  -0.05  -0.07    -0.00   0.00   0.02
    10   1     0.00   0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    11   1     0.00  -0.00   0.00    -0.00  -0.00  -0.00     0.00  -0.00   0.00
    12   1    -0.00   0.00   0.00     0.00  -0.01  -0.00     0.00   0.00   0.00
    13   1    -0.00   0.01   0.00    -0.00   0.00   0.00    -0.00   0.00  -0.00
    14   1    -0.02   0.00   0.07     0.00  -0.00  -0.01    -0.00  -0.00   0.00
    15   6    -0.01   0.01  -0.01     0.00   0.00  -0.00     0.04  -0.00  -0.05
    16   1     0.27   0.12  -0.17     0.20   0.08  -0.11     0.54   0.23  -0.29
    17   1     0.14  -0.05   0.82     0.01  -0.01   0.09    -0.05   0.01  -0.25
    18   1    -0.00  -0.02   0.06    -0.01  -0.10   0.17     0.00   0.05  -0.09
    19   1     0.01  -0.13  -0.13    -0.08   0.69   0.63     0.01  -0.10  -0.09
    20   1    -0.04   0.00   0.20    -0.00  -0.00   0.02    -0.09   0.01   0.49
    21   1     0.21   0.02  -0.03    -0.00  -0.00   0.00    -0.47  -0.05   0.05
    22   1    -0.06  -0.20  -0.08    -0.00  -0.01  -0.00     0.03   0.06   0.01
                     55                     56                     57
                      A                      A                      A
 Frequencies --   3089.9642              3093.2323              3160.9321
 Red. masses --      1.1009                 1.1013                 1.0856
 Frc consts  --      6.1929                 6.2082                 6.3910
 IR Inten    --     54.3604                47.0453                 5.9444
 RamAct Fr= 1--    162.5445                92.3760                33.7192
  Dep-P Fr= 1--      0.5886                 0.4470                 0.6316
  Dep-U Fr= 1--      0.7410                 0.6178                 0.7742
 Alpha2 Fr= 1--      0.4895                 0.5732                 0.0725
 Beta2  Fr= 1--     20.0742                 9.5115                 4.3508
 AlphaG Fr= 1--      0.6782                -0.7501                -0.0391
 Gamma2 Fr= 1--     12.7983                51.2427                -0.2967
 Delta2 Fr= 1--      1.3147                44.3388                 0.6425
 Raman1 Fr= 1--     650.178                369.504                134.877
 ROA1   Fr= 1--    1270.712               6338.139                 -7.927
 CID1   Fr= 1--       1.954                 17.153                 -0.059
 Raman2 Fr= 1--     240.890                114.138                 52.210
 ROA2   Fr= 1--     296.642                875.114                -12.262
 CID2   Fr= 1--       1.231                  7.667                 -0.235
 Raman3 Fr= 1--     481.780                228.276                104.419
 ROA3   Fr= 1--    1270.712               6338.139                 -7.927
 CID3   Fr= 1--       2.638                 27.765                 -0.076
 RC180  Fr= 1--       0.482                  0.236                  0.548
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00  -0.00     0.00  -0.00  -0.00     0.02   0.03  -0.00
     2   6    -0.00  -0.00   0.00     0.00   0.00   0.00    -0.04   0.01   0.01
     3   6    -0.00   0.00  -0.00    -0.00  -0.00   0.00     0.02  -0.05  -0.01
     4   6     0.00  -0.00   0.00    -0.00   0.00  -0.00    -0.00  -0.00   0.00
     5   6     0.00  -0.00   0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
     6   6    -0.00   0.00   0.00    -0.00   0.00   0.00     0.01  -0.03  -0.00
     7   6    -0.00  -0.00   0.00     0.00  -0.00  -0.01    -0.00  -0.00  -0.00
     8   6    -0.03  -0.01   0.03     0.03   0.01  -0.03     0.00   0.00  -0.00
     9   6    -0.00   0.00   0.01     0.00  -0.00  -0.01     0.00  -0.00  -0.00
    10   1     0.00   0.00   0.00     0.00   0.00  -0.00    -0.26  -0.31   0.01
    11   1     0.00   0.00   0.00    -0.00   0.00   0.00     0.49  -0.08  -0.06
    12   1     0.00  -0.00   0.00    -0.00  -0.00  -0.00    -0.23   0.62   0.08
    13   1     0.01  -0.02  -0.00     0.01  -0.02  -0.00    -0.12   0.33   0.04
    14   1     0.01  -0.00  -0.04    -0.02   0.01   0.11    -0.00   0.00   0.00
    15   6    -0.07  -0.05  -0.00     0.00  -0.04  -0.07    -0.00  -0.00  -0.00
    16   1     0.34   0.14  -0.18    -0.38  -0.16   0.20    -0.00  -0.00   0.00
    17   1    -0.03   0.01  -0.15     0.04  -0.01   0.21     0.00   0.00   0.00
    18   1     0.00   0.03  -0.05    -0.00  -0.03   0.06     0.00   0.00  -0.00
    19   1     0.01  -0.05  -0.05    -0.01   0.06   0.05     0.00   0.01   0.01
    20   1     0.00  -0.01  -0.10    -0.12  -0.01   0.57    -0.00  -0.00   0.00
    21   1     0.65   0.06  -0.09    -0.09  -0.02  -0.00     0.00   0.00  -0.00
    22   1     0.16   0.53   0.23     0.17   0.53   0.21     0.00   0.01   0.00
                     58                     59                     60
                      A                      A                      A
 Frequencies --   3167.0193              3178.1278              3191.0599
 Red. masses --      1.0880                 1.0920                 1.0966
 Frc consts  --      6.4296                 6.4987                 6.5791
 IR Inten    --      2.1158                28.2482                22.0176
 RamAct Fr= 1--    141.2843                62.7471               303.9440
  Dep-P Fr= 1--      0.5632                 0.7440                 0.1094
  Dep-U Fr= 1--      0.7205                 0.8532                 0.1973
 Alpha2 Fr= 1--      0.5004                 0.0064                 5.1997
 Beta2  Fr= 1--     16.9669                 8.9225                 9.9942
 AlphaG Fr= 1--      0.0250                -0.0211                 0.2920
 Gamma2 Fr= 1--      0.5690                 0.1210                 2.4465
 Delta2 Fr= 1--      0.5350                -2.9418                 2.4458
 Raman1 Fr= 1--     565.137                250.988               1215.776
 ROA1   Fr= 1--      71.740                -82.521                313.130
 CID1   Fr= 1--       0.127                 -0.329                  0.258
 Raman2 Fr= 1--     203.603                107.070                119.930
 ROA2   Fr= 1--       9.376                 26.438                 39.150
 CID2   Fr= 1--       0.046                  0.247                  0.326
 Raman3 Fr= 1--     407.205                214.141                239.860
 ROA3   Fr= 1--      71.740                -82.521                313.130
 CID3   Fr= 1--       0.176                 -0.385                  1.305
 RC180  Fr= 1--       0.441                  0.706                 -0.605
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.02   0.03  -0.00     0.03   0.03  -0.00    -0.04  -0.05   0.00
     2   6     0.01  -0.00  -0.00    -0.05   0.01   0.01    -0.06   0.01   0.01
     3   6    -0.02   0.05   0.01    -0.01   0.03   0.00    -0.01   0.02   0.00
     4   6     0.00   0.00  -0.00     0.00  -0.00  -0.00     0.00   0.00  -0.00
     5   6     0.00   0.00  -0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
     6   6     0.02  -0.06  -0.01    -0.02   0.04   0.01     0.01  -0.02  -0.00
     7   6     0.00  -0.00  -0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
     8   6     0.00   0.00  -0.00    -0.00  -0.00   0.00     0.00   0.00   0.00
     9   6    -0.00   0.00   0.00    -0.00   0.00   0.00    -0.00   0.00   0.00
    10   1    -0.28  -0.34   0.01    -0.30  -0.35   0.01     0.42   0.50  -0.01
    11   1    -0.09   0.02   0.01     0.55  -0.09  -0.07     0.63  -0.10  -0.08
    12   1     0.20  -0.52  -0.06     0.14  -0.38  -0.05     0.08  -0.23  -0.03
    13   1    -0.23   0.65   0.07     0.18  -0.51  -0.06    -0.10   0.28   0.03
    14   1    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00   0.00   0.00
    15   6    -0.00  -0.00  -0.00     0.00   0.00   0.00    -0.00  -0.00  -0.00
    16   1    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    17   1     0.00   0.00  -0.00    -0.00  -0.00  -0.00    -0.00   0.00  -0.00
    18   1    -0.00  -0.00   0.00    -0.00  -0.00   0.00    -0.00  -0.00   0.00
    19   1    -0.00  -0.01  -0.01    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00
    20   1    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    21   1     0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00   0.00  -0.00
    22   1     0.01   0.02   0.01    -0.00  -0.01  -0.01     0.00   0.01   0.00

 -------------------
 - Thermochemistry -
 -------------------
 Temperature   298.150 Kelvin.  Pressure   1.00000 Atm.
 Atom     1 has atomic number  6 and mass  12.00000
 Atom     2 has atomic number  6 and mass  12.00000
 Atom     3 has atomic number  6 and mass  12.00000
 Atom     4 has atomic number  6 and mass  12.00000
 Atom     5 has atomic number  6 and mass  12.00000
 Atom     6 has atomic number  6 and mass  12.00000
 Atom     7 has atomic number  6 and mass  12.00000
 Atom     8 has atomic number  6 and mass  12.00000
 Atom     9 has atomic number  6 and mass  12.00000
 Atom    10 has atomic number  1 and mass   1.00783
 Atom    11 has atomic number  1 and mass   1.00783
 Atom    12 has atomic number  1 and mass   1.00783
 Atom    13 has atomic number  1 and mass   1.00783
 Atom    14 has atomic number  1 and mass   1.00783
 Atom    15 has atomic number  6 and mass  12.00000
 Atom    16 has atomic number  1 and mass   1.00783
 Atom    17 has atomic number  1 and mass   1.00783
 Atom    18 has atomic number  1 and mass   1.00783
 Atom    19 has atomic number  1 and mass   1.00783
 Atom    20 has atomic number  1 and mass   1.00783
 Atom    21 has atomic number  1 and mass   1.00783
 Atom    22 has atomic number  1 and mass   1.00783
 Molecular mass:   132.09390 amu.
 Principal axes and moments of inertia in atomic units:
                           1         2         3
     Eigenvalues --   754.660911465.567862134.52425
           X            0.99990  -0.01400   0.00153
           Y            0.01401   0.99990  -0.00236
           Z           -0.00150   0.00238   1.00000
 This molecule is an asymmetric top.
 Rotational symmetry number  1.
 Warning -- assumption of classical behavior for rotation
           may cause significant error
 Rotational temperatures (Kelvin)      0.11477     0.05910     0.04058
 Rotational constants (GHZ):           2.39146     1.23143     0.84550
 Zero-point vibrational energy     504249.2 (Joules/Mol)
                                  120.51845 (Kcal/Mol)
 Warning -- explicit consideration of  11 degrees of freedom as
           vibrations may cause significant error
 Vibrational temperatures:    153.01   214.52   304.21   342.74   380.22
          (Kelvin)            571.91   609.32   660.34   748.09   768.79
                              853.78   894.16  1054.05  1081.05  1104.70
                             1172.50  1234.12  1268.81  1321.23  1346.69
                             1383.98  1395.29  1414.20  1492.31  1515.07
                             1586.09  1591.81  1626.48  1701.10  1704.54
                             1718.16  1752.08  1787.75  1866.12  1878.97
                             1905.96  1920.85  1955.21  1967.55  2033.12
                             2134.94  2146.11  2156.85  2157.48  2162.62
                             2180.47  2342.34  2374.84  4280.65  4331.32
                             4355.40  4362.86  4420.50  4442.61  4445.77
                             4450.47  4547.88  4556.63  4572.62  4591.22
 
 Zero-point correction=                           0.192058 (Hartree/Particle)
 Thermal correction to Energy=                    0.200364
 Thermal correction to Enthalpy=                  0.201308
 Thermal correction to Gibbs Free Energy=         0.159215
 Sum of electronic and zero-point Energies=           -388.292300
 Sum of electronic and thermal Energies=              -388.283994
 Sum of electronic and thermal Enthalpies=            -388.283050
 Sum of electronic and thermal Free Energies=         -388.325143
 
                     E (Thermal)             CV                S
                      KCal/Mol        Cal/Mol-Kelvin    Cal/Mol-Kelvin
 Total                  125.730             33.807             88.593
 Electronic               0.000              0.000              0.000
 Translational            0.889              2.981             40.548
 Rotational               0.889              2.981             29.247
 Vibrational            123.953             27.846             18.798
 Vibration     1          0.605              1.944              3.334
 Vibration     2          0.618              1.904              2.684
 Vibration     3          0.643              1.823              2.031
 Vibration     4          0.656              1.782              1.816
 Vibration     5          0.671              1.738              1.633
 Vibration     6          0.764              1.475              0.972
 Vibration     7          0.786              1.419              0.880
 Vibration     8          0.817              1.341              0.769
 Vibration     9          0.875              1.206              0.610
 Vibration    10          0.889              1.174              0.578
 Vibration    11          0.951              1.046              0.461
                       Q            Log10(Q)             Ln(Q)
 Total Bot       0.583844D-73        -73.233703       -168.626833
 Total V=0       0.127920D+16         15.106939         34.785013
 Vib (Bot)       0.177887D-86        -86.749856       -199.748926
 Vib (Bot)    1  0.192730D+01          0.284950          0.656122
 Vib (Bot)    2  0.136029D+01          0.133631          0.307697
 Vib (Bot)    3  0.938816D+00         -0.027420         -0.063136
 Vib (Bot)    4  0.823777D+00         -0.084190         -0.193855
 Vib (Bot)    5  0.733437D+00         -0.134637         -0.310013
 Vib (Bot)    6  0.449216D+00         -0.347545         -0.800251
 Vib (Bot)    7  0.413505D+00         -0.383520         -0.883086
 Vib (Bot)    8  0.370916D+00         -0.430725         -0.991781
 Vib (Bot)    9  0.310454D+00         -0.508003         -1.169720
 Vib (Bot)   10  0.298092D+00         -0.525649         -1.210352
 Vib (Bot)   11  0.253337D+00         -0.596301         -1.373035
 Vib (V=0)       0.389750D+02          1.590786          3.662920
 Vib (V=0)    1  0.249110D+01          0.396392          0.912726
 Vib (V=0)    2  0.194927D+01          0.289872          0.667455
 Vib (V=0)    3  0.156366D+01          0.194143          0.447030
 Vib (V=0)    4  0.146364D+01          0.165435          0.380929
 Vib (V=0)    5  0.138765D+01          0.142281          0.327615
 Vib (V=0)    6  0.117216D+01          0.068986          0.158846
 Vib (V=0)    7  0.114883D+01          0.060257          0.138748
 Vib (V=0)    8  0.112256D+01          0.050209          0.115610
 Vib (V=0)    9  0.108854D+01          0.036845          0.084839
 Vib (V=0)   10  0.108212D+01          0.034274          0.078918
 Vib (V=0)   11  0.106052D+01          0.025518          0.058757
 Electronic      0.100000D+01          0.000000          0.000000
 Translational   0.596730D+08          7.775778         17.904391
 Rotational      0.550016D+06          5.740375         13.217702
 
                                                          ROA calculations.
                                                             IR Spectrum
 
   333333333332                                                   11111111111111111111 11111                                         
   111100000009                                                   66555444433333222111 111009999988 8777    65 55 4 43    222  11    
   976699873217                                                   52100998165320941988 300538763185 1653    29 32 5 29    631  40    
   187130822705                                                   18530924389556738452 062373026828 5813    13 40 9 37    481  96    
 
   XXXXXXXXXXXX                                                   XXXXXXXXXXXXXXXX XXX XXXXXXX XXXX XXXX    XX XX X XX    X X  X     
   XX XXX XXXXX                                                     XX  X  XX                        XX           X                  
   XX  XX XXXXX                                                     XX                               XX                              
   XX  XX XXXXX                                                     X                                XX                              
   XX  XX XXXXX                                                     X                                XX                              
   XX  XX XX XX                                                     X                                XX                              
   XX  XX XX XX                                                                                      XX                              
   XX  XX XX XX                                                                                      X                               
    X  XX XX X                                                                                       X                               
    X  XX XX X                                                                                       X                               
       XX XX X                                                                                       X                               
       XX XX                                                                                         X                               
       XX  X                                                                                         X                               
       XX  X                                                                                         X                               
       XX  X                                                                                                                         
       XX  X                                                                                                                         
       XX  X                                                                                                                         
        X  X                                                                                                                         
        X                                                                                                                            
        X                                                                                                                            
 
 ***** Axes restored to original set *****
 -------------------------------------------------------------------
 Center     Atomic                   Forces (Hartrees/Bohr)
 Number     Number              X              Y              Z
 -------------------------------------------------------------------
      1        6          -0.000002085   -0.000006530    0.000001263
      2        6           0.000006560   -0.000001017   -0.000006946
      3        6           0.000000078   -0.000004377    0.000003077
      4        6           0.000002773    0.000008929    0.000000518
      5        6          -0.000015820    0.000013508    0.000003209
      6        6          -0.000001967    0.000001316   -0.000001321
      7        6           0.000009431   -0.000006724    0.000002191
      8        6           0.000000702    0.000001906    0.000003993
      9        6          -0.000001293   -0.000007184   -0.000000782
     10        1          -0.000000442   -0.000000205    0.000000005
     11        1           0.000000225   -0.000000429    0.000000023
     12        1           0.000000010    0.000000447   -0.000000414
     13        1           0.000001297   -0.000000295   -0.000001106
     14        1           0.000000957   -0.000000083   -0.000000071
     15        6          -0.000003738   -0.000000406    0.000000295
     16        1          -0.000000323    0.000001379   -0.000000358
     17        1          -0.000000835    0.000000397   -0.000003222
     18        1           0.000001117   -0.000000020   -0.000000430
     19        1          -0.000001342   -0.000000500   -0.000001205
     20        1           0.000001368   -0.000001377    0.000000185
     21        1           0.000000210    0.000000992    0.000000039
     22        1           0.000003118    0.000000275    0.000001056
 -------------------------------------------------------------------
 Cartesian Forces:  Max     0.000015820 RMS     0.000003841
 End of FrcOut F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) frequency  1    0.085645:
                 1             2             3 
      1   0.147336D+03  0.185567D+01 -0.348524D+01
      2   0.185567D+01  0.129405D+03  0.148588D+01
      3  -0.348524D+01  0.148588D+01  0.825990D+02
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.085645:
                 1             2             3 
      1   0.439692D+00  0.959180D+00  0.196300D+01
      2   0.103121D+02 -0.566690D+01  0.126949D+02
      3   0.448775D+00  0.320528D+02  0.520413D+01
 Property number 4 -- D-Q polarizability frequency  1    0.085645:
                 1             2             3 
      1  -0.739893D+02 -0.151899D+02  0.137173D+02
      2   0.387046D+02  0.160040D+01 -0.137562D+02
      3   0.352847D+02  0.135895D+02  0.388817D-01
      4  -0.275242D+02 -0.332348D+02 -0.108300D+02
      5   0.149339D+02 -0.138474D+02  0.323531D+02
      6  -0.723586D+01 -0.125287D+01  0.731317D+00
 End of FrcOut F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=    66 ND12= 1 LenFil=    2379:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.274745D+00 -0.991059D+00 -0.760802D+00 -0.517803D+01 -0.849827D-01
      2  -0.991059D+00 -0.234371D+01 -0.669696D+00 -0.849827D-01 -0.241399D+01
      3  -0.760802D+00 -0.669696D+00 -0.166928D+01  0.536409D+00  0.537188D+00
                 6             7             8             9            10 
      1   0.536409D+00 -0.127094D+01 -0.116130D+00 -0.351903D+01 -0.458644D+01
      2   0.537188D+00 -0.116130D+00  0.410147D+00 -0.381165D+01  0.760261D+00
      3  -0.299240D+01 -0.351903D+01 -0.381165D+01 -0.193151D-01 -0.652399D+00
                11            12            13            14            15 
      1   0.760261D+00 -0.652399D+00  0.152116D+01  0.222966D+01  0.321305D+00
      2  -0.266749D+01  0.218451D-01  0.222966D+01  0.230589D+01 -0.409139D+00
      3   0.218451D-01 -0.305814D+01  0.321305D+00 -0.409139D+00  0.942836D+00
                16            17            18            19            20 
      1  -0.691389D+00  0.635175D+00 -0.526390D+01  0.909929D+00 -0.290783D+01
      2   0.635175D+00  0.273150D+00  0.691568D+00 -0.290783D+01 -0.356950D+01
      3  -0.526390D+01  0.691568D+00  0.145900D+01 -0.258797D+00  0.501833D+00
                21            22            23            24            25 
      1  -0.258797D+00  0.511129D+01 -0.366558D+00 -0.382540D-01  0.174581D+00
      2   0.501833D+00 -0.366558D+00  0.409690D+00 -0.467934D+00  0.937832D+00
      3  -0.569120D+00 -0.382540D-01 -0.467934D+00  0.265318D+01 -0.234999D+01
                26            27            28            29            30 
      1   0.937832D+00 -0.234999D+01  0.795229D+00  0.269264D+01 -0.274895D+00
      2  -0.526184D+00  0.346363D+01  0.269264D+01  0.706098D+01 -0.160221D+00
      3   0.346363D+01  0.145536D+01 -0.274895D+00 -0.160221D+00  0.194627D+01
                31            32            33            34            35 
      1   0.115214D+02  0.422049D+01 -0.907754D+00  0.164371D+01 -0.285208D+00
      2   0.422049D+01  0.631953D+01 -0.519789D+00 -0.285208D+00 -0.287044D+00
      3  -0.907754D+00 -0.519789D+00  0.154004D+01  0.149605D+01  0.296052D+01
                36            37            38            39            40 
      1   0.149605D+01  0.148039D+02 -0.172945D+01 -0.186067D+01 -0.599777D+01
      2   0.296052D+01 -0.172945D+01  0.365250D+01  0.646644D-01 -0.315640D+01
      3  -0.981834D-01 -0.186067D+01  0.646644D-01  0.235530D+01 -0.102178D+00
                41            42            43            44            45 
      1  -0.315640D+01 -0.102178D+00 -0.143974D+01 -0.444660D+00  0.308203D+01
      2  -0.419933D+00  0.518917D+00 -0.444660D+00  0.415877D+00 -0.834943D+00
      3   0.518917D+00  0.338543D+00  0.308203D+01 -0.834943D+00 -0.136161D+01
                46            47            48            49            50 
      1  -0.154357D+01  0.323572D+01  0.370619D+00 -0.558529D+01  0.521285D+00
      2   0.323572D+01  0.199011D+01 -0.329997D+00  0.521285D+00 -0.193423D+01
      3   0.370619D+00 -0.329997D+00  0.112965D+01  0.177696D+00  0.372397D+00
                51            52            53            54            55 
      1   0.177696D+00  0.913175D-01 -0.508875D+00  0.391076D+00 -0.363358D+01
      2   0.372397D+00 -0.508875D+00  0.469045D-01 -0.394509D+01  0.236846D+01
      3  -0.241878D+01  0.391076D+00 -0.394509D+01 -0.119736D+01  0.103955D+01
                56            57            58            59            60 
      1   0.236846D+01  0.103955D+01  0.303496D+01 -0.354450D+01  0.321069D+00
      2  -0.244663D+01  0.208262D+00 -0.354450D+01 -0.220550D+01 -0.167549D+01
      3   0.208262D+00 -0.230440D+01  0.321069D+00 -0.167549D+01  0.766830D+00
                61            62            63            64            65 
      1   0.284629D+01  0.247968D+00 -0.355487D+01 -0.420324D+01 -0.383081D+01
      2   0.247968D+00 -0.240551D+01  0.415550D+00 -0.383081D+01  0.116903D+01
      3  -0.355487D+01  0.415550D+00  0.907770D+01  0.228224D+01  0.749521D+00
                66            67            68            69            70 
      1   0.228224D+01 -0.384357D+01  0.780746D+00  0.953332D+00  0.355943D+01
      2   0.749521D+00  0.780746D+00  0.284878D+01  0.144148D+01  0.165944D+01
      3  -0.146698D+01  0.953332D+00  0.144148D+01  0.513605D+00 -0.261638D+01
                71            72            73            74            75 
      1   0.165944D+01 -0.261638D+01 -0.227677D+01  0.966253D+00 -0.160511D+00
      2   0.184304D+01  0.167759D+00  0.966253D+00 -0.208856D+01  0.982298D+00
      3   0.167759D+00 -0.644609D+01 -0.160511D+00  0.982298D+00 -0.175327D+00
                76            77            78            79            80 
      1   0.555018D+00 -0.367540D+01  0.968374D+00  0.532283D+00  0.174738D+01
      2  -0.367540D+01 -0.805255D+01 -0.549233D+00  0.174738D+01 -0.225086D+00
      3   0.968374D+00 -0.549233D+00 -0.382449D+01 -0.147072D+01 -0.631181D+01
                81            82            83            84            85 
      1  -0.147072D+01 -0.574599D+01 -0.431960D+01  0.184989D+00 -0.405543D+01
      2  -0.631181D+01 -0.431960D+01 -0.377957D+01  0.173568D+00 -0.473533D+01
      3   0.367162D+01  0.184989D+00  0.173568D+00 -0.535751D+00 -0.395961D-01
                86            87            88            89            90 
      1  -0.473533D+01 -0.395961D-01  0.352832D+00  0.185040D+00  0.621916D-02
      2  -0.661309D+01  0.181819D-02  0.185040D+00  0.161122D-01  0.244978D-01
      3   0.181819D-02 -0.641275D+00  0.621916D-02  0.244978D-01  0.371704D-02
                91            92            93            94            95 
      1  -0.137099D+02  0.139838D+01  0.144572D+01  0.151610D+01 -0.176798D+01
      2   0.139838D+01 -0.857606D+00 -0.163400D+00 -0.176798D+01  0.528629D+00
      3   0.144572D+01 -0.163400D+00 -0.990864D+00 -0.328066D+00  0.208858D+00
                96            97            98            99           100 
      1  -0.328066D+00  0.171581D+01 -0.353559D+00 -0.103216D+00 -0.223831D+01
      2   0.208858D+00 -0.353559D+00  0.187239D+00  0.445291D-01  0.248439D+01
      3   0.204161D+00 -0.103216D+00  0.445291D-01  0.101269D+00  0.364018D+00
               101           102           103           104           105 
      1   0.248439D+01  0.364018D+00  0.234563D+01 -0.377173D+01 -0.384969D+00
      2  -0.269123D+01 -0.401104D+00 -0.377173D+01  0.929455D+01  0.944726D+00
      3  -0.401104D+00 -0.395787D+00 -0.384969D+00  0.944726D+00  0.873230D+00
               106           107           108           109           110 
      1   0.377780D+00 -0.553147D+00 -0.158637D+00  0.125635D+01 -0.172670D+01
      2  -0.553147D+00  0.115186D+01  0.256312D+00 -0.172670D+01  0.195952D+01
      3  -0.158637D+00  0.256312D+00  0.119171D+00 -0.146783D+00  0.308165D+00
               111           112           113           114           115 
      1  -0.146783D+00 -0.131305D+01  0.179435D+01  0.132519D+00 -0.216995D+00
      2   0.308165D+00  0.179435D+01 -0.944092D+01 -0.922632D+00  0.268000D+00
      3   0.182358D+00  0.132519D+00 -0.922632D+00 -0.832771D+00 -0.120399D-01
               116           117           118           119           120 
      1   0.268000D+00 -0.120399D-01  0.257468D+01 -0.620313D+00 -0.206419D+01
      2  -0.902523D+00 -0.140197D+00 -0.620313D+00  0.701664D+00  0.112059D+00
      3  -0.140197D+00 -0.167729D+00 -0.206419D+01  0.112059D+00  0.188523D+01
               121           122           123           124           125 
      1  -0.101376D+01  0.156805D+01  0.152511D+00 -0.531707D+01  0.540129D+00
      2   0.156805D+01 -0.367973D+00 -0.104935D+01  0.540129D+00 -0.117318D+01
      3   0.152511D+00 -0.104935D+01 -0.386520D+00  0.392650D+01 -0.713195D+00
               126           127           128           129           130 
      1   0.392650D+01 -0.813572D+01 -0.798261D+00  0.142807D+01 -0.395491D+01
      2  -0.713195D+00 -0.798261D+00  0.317705D+01 -0.353530D+00  0.326997D+01
      3  -0.969917D+01  0.142807D+01 -0.353530D+00  0.173902D+01 -0.527811D+00
               131           132           133           134           135 
      1   0.326997D+01 -0.527811D+00  0.228811D+01 -0.117155D+01  0.118632D+01
      2   0.292317D+01  0.285046D+01 -0.117155D+01  0.337671D+01  0.744159D+00
      3   0.285046D+01  0.225430D-01  0.118632D+01  0.744159D+00 -0.645646D+01
               136           137           138           139           140 
      1   0.948191D+01  0.338814D+01 -0.188604D+01  0.298094D+01  0.227654D+01
      2   0.338814D+01  0.200119D+01 -0.659514D+00  0.227654D+01  0.178360D+01
      3  -0.188604D+01 -0.659514D+00  0.133828D+01 -0.646764D+00 -0.813859D+00
               141           142           143           144           145 
      1  -0.646764D+00 -0.389805D+01 -0.137195D+01  0.220806D+01  0.160270D+01
      2  -0.813859D+00 -0.137195D+01 -0.135890D+01  0.865702D+00  0.535411D+00
      3   0.488398D+00  0.220806D+01  0.865702D+00 -0.770189D+00  0.137825D+01
               146           147           148           149           150 
      1   0.535411D+00  0.137825D+01  0.143735D+00  0.485047D+00 -0.183483D+00
      2  -0.214311D-02  0.141525D+00  0.485047D+00 -0.198631D+00  0.772092D+00
      3   0.141525D+00  0.932392D+00 -0.183483D+00  0.772092D+00 -0.399684D+00
               151           152           153           154           155 
      1   0.219506D+01  0.296882D-01  0.303900D+01  0.102651D+01  0.838712D+00
      2   0.296882D-01  0.136660D+01  0.628733D+00  0.838712D+00  0.233246D+00
      3   0.303900D+01  0.628733D+00  0.750004D+01 -0.107416D+01 -0.365107D+00
               156           157           158           159           160 
      1  -0.107416D+01  0.828441D+00  0.166344D+01 -0.645504D+00 -0.277678D+01
      2  -0.365107D+00  0.166344D+01  0.556933D+01 -0.272917D+01 -0.201380D+01
      3   0.371169D+00 -0.645504D+00 -0.272917D+01  0.235718D+01  0.143308D+01
               161           162           163           164           165 
      1  -0.201380D+01  0.143308D+01 -0.245647D+00  0.775027D+00  0.766681D+00
      2  -0.518682D+01  0.501436D+01  0.775027D+00 -0.824549D+00 -0.209852D+00
      3   0.501436D+01 -0.648711D+01  0.766681D+00 -0.209852D+00 -0.157394D+00
               166           167           168           169           170 
      1   0.130417D+01  0.121872D+01  0.179382D+00  0.104597D+01  0.322629D+00
      2   0.121872D+01  0.903529D+01  0.280020D+01  0.322629D+00  0.479395D+01
      3   0.179382D+00  0.280020D+01  0.211280D+01  0.534550D+00  0.363789D+01
               171           172           173           174           175 
      1   0.534550D+00  0.246158D+00  0.790279D-01  0.710600D+00  0.682757D+00
      2   0.363789D+01  0.790279D-01 -0.733663D+00  0.217931D+00 -0.294861D+00
      3   0.209226D+01  0.710600D+00  0.217931D+00 -0.112850D+01  0.808601D-01
               176           177           178           179           180 
      1  -0.294861D+00  0.808601D-01  0.146554D+01 -0.507363D+00  0.622400D+00
      2  -0.605788D+00  0.696005D+00 -0.507363D+00  0.148769D+01 -0.139514D+01
      3   0.696005D+00 -0.714255D-01  0.622400D+00 -0.139514D+01  0.769097D+01
               181           182           183           184           185 
      1   0.131137D+02 -0.193228D+01 -0.319131D+00  0.708318D+00  0.930959D+00
      2  -0.193228D+01  0.140943D+01 -0.735780D-01  0.930959D+00 -0.419796D+00
      3  -0.319131D+00 -0.735780D-01  0.106164D+01  0.741897D-01 -0.384339D+00
               186           187           188           189           190 
      1   0.741897D-01 -0.152022D+01  0.329457D+00  0.125059D+01  0.233334D+00
      2  -0.384339D+00  0.329457D+00 -0.769217D+00 -0.263567D+00 -0.666118D+00
      3   0.152587D+00  0.125059D+01 -0.263567D+00  0.127961D+00 -0.512355D+00
               191           192           193           194           195 
      1  -0.666118D+00 -0.512355D+00 -0.131216D+01  0.438480D+00 -0.932685D-01
      2  -0.135005D+01 -0.956722D-01  0.438480D+00 -0.834605D+01 -0.162321D+01
      3  -0.956722D-01 -0.489778D+00 -0.932685D-01 -0.162321D+01 -0.139859D+01
               196           197           198 
      1  -0.115753D+01  0.423513D+00 -0.127094D+00
      2   0.423513D+00 -0.253481D+01 -0.149963D+01
      3  -0.127094D+00 -0.149963D+01 -0.595840D+00
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.131058D+01 -0.163320D+00 -0.461044D+01  0.106451D+01  0.548735D-01
      2   0.729038D+00  0.933601D+00  0.323810D+01 -0.205334D+00 -0.674865D+00
      3  -0.636697D+01 -0.109576D+02 -0.529821D-01  0.832264D+01 -0.383138D+01
                 6             7             8             9            10 
      1  -0.183894D+01 -0.790023D+01  0.333363D+01  0.119916D+01  0.501316D+00
      2   0.792174D+01 -0.230574D+01  0.113748D+02  0.126366D+01  0.388700D+00
      3   0.203194D+00  0.104898D+01  0.188987D+01 -0.533886D+01  0.376040D+01
                11            12            13            14            15 
      1   0.443968D+00  0.724673D+00  0.113564D+01 -0.126841D+01  0.296584D+01
      2  -0.323984D+00  0.959528D+01 -0.230482D+01 -0.151271D+00 -0.152267D+01
      3  -0.908498D+01 -0.125370D+00  0.107505D+02  0.426617D+01 -0.182852D+01
                16            17            18            19            20 
      1   0.227168D+01  0.117228D+02  0.117019D+01  0.100633D+01 -0.831415D+00
      2   0.837486D+01 -0.312660D+01 -0.340436D+01  0.648857D+00 -0.411239D-02
      3   0.122630D+01 -0.185822D+00  0.198651D+01 -0.280129D+01 -0.157120D+02
                21            22            23            24            25 
      1  -0.222028D+00 -0.100721D+01  0.455377D+00 -0.321694D+01  0.368854D+01
      2  -0.804240D+00  0.799193D+00  0.174415D+01 -0.706110D+01 -0.874890D+01
      3  -0.824613D+00  0.743076D+00  0.645109D+00 -0.464815D+00  0.936870D+00
                26            27            28            29            30 
      1   0.262619D+01 -0.408317D+00 -0.164057D+01  0.192574D+01 -0.148913D+01
      2  -0.971209D+01 -0.100499D+01 -0.330927D+01 -0.126831D+01 -0.108769D+01
      3   0.976268D+00  0.544143D+01 -0.370996D+01  0.527425D+01  0.158280D+01
                31            32            33            34            35 
      1   0.191613D+01  0.322621D+00 -0.126834D+01 -0.183444D+01  0.643180D+01
      2   0.192331D+01 -0.186944D+01 -0.149187D+01 -0.146543D+02 -0.146633D+01
      3   0.992292D+01  0.203853D+02 -0.126828D+01  0.240608D+01 -0.157701D+01
                36            37            38            39            40 
      1   0.512973D+00  0.614031D+00  0.145034D+01  0.160572D+01  0.215577D+01
      2   0.153024D+01 -0.152404D+01 -0.123057D+01 -0.535673D+00 -0.107687D+01
      3   0.333097D+01 -0.837776D+01  0.105721D+02  0.143136D+01  0.960915D+01
                41            42            43            44            45 
      1  -0.281854D-02 -0.360139D+00  0.321535D+01  0.100030D+02 -0.311254D+00
      2   0.348579D+00  0.541499D+00 -0.132468D+02  0.357487D+00  0.134134D+01
      3  -0.580549D+01 -0.142235D+01 -0.291654D+00 -0.546657D+01 -0.242061D+01
                46            47            48            49            50 
      1   0.668708D+00 -0.590008D+00  0.421879D+01 -0.341156D+00 -0.106598D+01
      2  -0.290544D+01  0.198186D+01 -0.285872D+01 -0.139641D+00  0.708848D+00
      3   0.999438D+01 -0.435145D+01 -0.236251D+01  0.788002D+01 -0.645890D+01
                51            52            53            54            55 
      1  -0.374289D+01  0.406272D+01  0.111243D+01 -0.164130D+01 -0.117729D+01
      2   0.216419D+01 -0.138114D+02  0.197837D+01  0.196991D+01 -0.369851D+00
      3   0.101248D+00 -0.406613D+01  0.112582D+01 -0.510119D+01 -0.276177D+01
                56            57            58            59            60 
      1   0.212081D+01 -0.135245D+01  0.297759D+01 -0.112617D+01 -0.148446D+01
      2   0.964745D+00 -0.109826D+01  0.141637D+01 -0.606858D+01  0.101881D+01
      3  -0.232564D+01 -0.102008D+01  0.124032D+02  0.816067D+01  0.463797D+01
                61            62            63            64            65 
      1  -0.349756D+01  0.637725D+01  0.330308D+01 -0.348772D+01 -0.120832D+01
      2  -0.106892D+02  0.101887D+01  0.141064D+02  0.734770D+01  0.356914D+01
      3  -0.345150D+01  0.743539D+01  0.194588D+01  0.872933D+01 -0.134873D+02
                66            67            68            69            70 
      1   0.197863D+01 -0.191598D+01 -0.344584D+01 -0.266174D+01  0.417435D+01
      2  -0.199259D+01  0.414806D+01  0.363614D+01  0.619284D+00 -0.120523D+02
      3   0.156714D+01 -0.857350D+01 -0.603079D+01 -0.346367D+01  0.774482D+00
                71            72            73            74            75 
      1   0.203705D+01  0.647174D+01  0.651562D+00 -0.272960D+01 -0.797108D-01
      2  -0.129891D+01 -0.131679D+02 -0.134355D+01  0.983733D+00  0.204646D+01
      3  -0.453282D+01 -0.350049D+01 -0.800457D+01  0.973660D+00 -0.156919D+01
                76            77            78            79            80 
      1  -0.101814D+01  0.504751D+01  0.724156D+01  0.525890D+01  0.222504D+02
      2   0.401814D+00  0.985968D-01 -0.257098D+01 -0.532105D+01 -0.558230D+01
      3   0.138535D+02 -0.470415D+01  0.408185D+01 -0.736734D+00  0.764193D+01
                81            82            83            84            85 
      1  -0.684504D+01  0.336647D+00  0.385892D+00 -0.243212D+01 -0.115321D+00
      2   0.294197D+01 -0.682065D+00 -0.705713D+00  0.308359D+01 -0.171472D-01
      3   0.188009D+01 -0.135873D+01 -0.489169D+01  0.288516D+00 -0.345091D+01
                86            87            88            89            90 
      1  -0.369997D-01 -0.326186D+01  0.112222D+01  0.167188D+01  0.798949D-01
      2  -0.197539D+00  0.312752D+01 -0.132092D+01 -0.111751D+01 -0.435907D-01
      3  -0.107058D+02  0.115553D+00 -0.298171D+00 -0.722748D+00  0.266615D+00
                91            92            93            94            95 
      1   0.251224D-01 -0.436413D+00  0.631927D+00 -0.179996D+00  0.128278D+00
      2  -0.206500D+01  0.264621D+00  0.628110D+01  0.953823D+00 -0.480612D+00
      3   0.239101D+01 -0.545139D+01 -0.325935D+00 -0.412816D+01  0.182353D+01
                96            97            98            99           100 
      1  -0.445279D+00 -0.543523D+00  0.478989D+00 -0.115963D+00 -0.784941D-01
      2  -0.106866D+01 -0.296154D+01  0.455076D+00 -0.366702D+00 -0.456886D+00
      3   0.583089D+00 -0.678411D+00  0.693460D+00 -0.950577D-01  0.976988D+00
               101           102           103           104           105 
      1   0.243742D+00  0.160090D+01  0.689974D-01  0.468823D+00 -0.431342D+01
      2   0.618608D+00  0.138437D+01  0.363984D+00 -0.174854D+01 -0.267902D+01
      3  -0.265969D+01 -0.398577D+00 -0.978553D+00  0.152848D+02  0.147580D+01
               106           107           108           109           110 
      1  -0.299513D+00  0.166856D+01 -0.339510D+00  0.238951D+00  0.139156D-01
      2  -0.991830D+00  0.369046D+00 -0.265211D+00  0.645406D+00 -0.670990D+00
      3  -0.324092D+00  0.128467D+01 -0.849177D-01 -0.680066D+01  0.556879D+01
               111           112           113           114           115 
      1   0.131556D+01 -0.293217D+00  0.747056D+00 -0.426109D+01 -0.356902D+00
      2   0.266780D+00 -0.838863D+00  0.966252D+00 -0.348429D+00 -0.123108D+01
      3   0.513649D+00  0.830985D+01 -0.122787D+02 -0.116808D+01  0.944927D+00
               116           117           118           119           120 
      1   0.193511D+01 -0.220054D+00 -0.725075D+00 -0.149007D+01  0.867497D+00
      2   0.290113D+00 -0.770330D-01 -0.133530D+01 -0.299782D-01  0.355787D+01
      3  -0.179966D+01 -0.104468D+00 -0.650960D+00 -0.355359D+01  0.117697D+01
               121           122           123           124           125 
      1  -0.135392D+01 -0.531849D+00 -0.854896D+00  0.980865D+00  0.282109D+01
      2   0.344038D+00 -0.240292D+00 -0.102312D+01  0.174766D+01 -0.635512D+00
      3  -0.233336D+01 -0.832987D+00  0.223834D+01  0.176492D+01  0.236316D+01
               126           127           128           129           130 
      1  -0.367899D+01  0.259846D+01  0.995269D-01  0.308400D+01 -0.220644D+01
      2  -0.154530D+02  0.802927D+01 -0.210004D+01  0.617092D+01 -0.265786D+01
      3  -0.158414D+00  0.214665D+02 -0.127740D+02 -0.162018D+01 -0.200090D+01
               131           132           133           134           135 
      1   0.936795D+01 -0.272446D+00  0.284892D+00  0.484165D+01 -0.107750D+02
      2   0.714992D+01  0.406530D+00 -0.313429D+00  0.292996D+01 -0.168302D+02
      3  -0.179523D+02 -0.811514D+01 -0.887655D+00 -0.810842D+01 -0.468238D+01
               136           137           138           139           140 
      1   0.251282D+01  0.555363D+00 -0.254309D+01  0.795347D+00  0.774654D+00
      2  -0.503450D+01 -0.193727D+01  0.601462D+01 -0.186134D+01 -0.197828D+01
      3   0.493327D+01 -0.400643D+01 -0.104868D+01  0.521181D+00 -0.229123D+01
               141           142           143           144           145 
      1  -0.157672D+01 -0.274494D+01  0.891240D-01  0.117726D+01 -0.129800D+01
      2   0.196385D+01  0.415352D+01  0.191455D+01 -0.267894D+01  0.195979D+01
      3   0.131432D+01 -0.217698D+01  0.302115D+01  0.849142D+00 -0.690791D-01
               146           147           148           149           150 
      1   0.214816D+00 -0.141969D+01  0.397869D+00 -0.148869D+01 -0.168973D+00
      2  -0.225353D+00  0.309267D+01 -0.673608D+00  0.131209D+01 -0.738907D+00
      3  -0.234591D+00  0.153014D+01  0.159644D+01  0.236971D+01 -0.195439D+01
               151           152           153           154           155 
      1  -0.374126D+01  0.262514D+01 -0.903983D+01  0.220719D+01  0.333046D+00
      2   0.319265D+01  0.149551D+01  0.168101D+02  0.337855D+00 -0.154920D+00
      3   0.356705D+01 -0.511187D+01  0.219312D+01  0.365273D+01  0.359384D+00
               156           157           158           159           160 
      1  -0.842738D+00  0.138784D+01  0.378795D+01 -0.664237D+01 -0.315821D+01
      2   0.114224D+01  0.955624D-01 -0.195243D+01  0.202714D+01 -0.874923D+00
      3  -0.251177D+01  0.161968D+01 -0.107589D+01  0.777463D+00 -0.619940D+01
               161           162           163           164           165 
      1  -0.867620D+01  0.145846D+02 -0.132341D+01  0.643485D+00  0.478025D+00
      2   0.384343D+01 -0.521574D+01  0.306230D+00 -0.399407D+00  0.717609D+00
      3  -0.186188D+00 -0.116000D+01 -0.117380D+01  0.931400D-01  0.199313D+01
               166           167           168           169           170 
      1  -0.135440D+01 -0.775357D+01 -0.764254D+01 -0.147230D+01 -0.800080D+01
      2  -0.536298D+00  0.228354D+01  0.167822D+01 -0.773884D+00  0.250510D+01
      3   0.474608D+01 -0.534812D+01 -0.246161D+01  0.433322D+01 -0.407855D+01
               171           172           173           174           175 
      1  -0.669213D+01  0.110082D+01 -0.634976D+00 -0.179014D+01 -0.174996D+00
      2   0.146607D+01  0.249290D+01  0.420194D+00 -0.240878D+01  0.849059D-01
      3  -0.243513D+01 -0.383668D+00  0.160651D+01 -0.178460D+01  0.120051D+01
               176           177           178           179           180 
      1   0.113119D+01 -0.109882D+01  0.357738D+00  0.133849D+01  0.138636D+02
      2   0.169784D+01 -0.426823D+00 -0.253811D+01 -0.307217D+01  0.196842D+02
      3   0.188558D+01 -0.171269D+01 -0.169911D+01 -0.345938D+01  0.362387D+01
               181           182           183           184           185 
      1  -0.276011D+00  0.184311D+00  0.203838D+01  0.319225D+00 -0.759992D+00
      2  -0.423876D+01 -0.113701D-01  0.615441D+01  0.206662D+00 -0.113872D+01
      3  -0.184063D+02 -0.456405D+01  0.105081D+01 -0.195586D+01 -0.301804D+00
               186           187           188           189           190 
      1  -0.490715D+00  0.158680D+01  0.311279D+00  0.298154D+00 -0.114480D+01
      2   0.537721D+00  0.214215D+01 -0.388141D+00  0.315526D+00 -0.136295D+01
      3   0.124390D+01  0.147032D+01  0.198117D+01 -0.109029D+01  0.403573D+01
               191           192           193           194           195 
      1  -0.530836D+00 -0.176255D+01 -0.516275D+00 -0.555083D+01 -0.591181D+01
      2   0.703988D-01 -0.653101D+00 -0.425938D+00 -0.344541D+01 -0.307493D+01
      3   0.491293D+01  0.177240D+01  0.561937D+01  0.237188D+02  0.533701D+01
               196           197           198 
      1  -0.530013D+00 -0.230535D+01 -0.185578D+01
      2  -0.145229D+01 -0.305476D+01 -0.117185D+01
      3   0.233669D+01  0.681613D+01  0.465418D+01
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.140438D+00 -0.250210D+02 -0.152103D+01  0.275997D+02  0.685032D+01
      2  -0.395704D+01  0.173636D+02 -0.698710D+00 -0.292251D+02 -0.127419D+02
      3   0.409748D+01  0.765733D+01  0.221974D+01  0.162541D+01  0.589159D+01
      4  -0.222834D+02  0.571675D+01  0.547767D+01  0.767060D+01 -0.142699D+02
      5   0.163036D+01  0.582060D+01  0.796540D+01  0.303098D+00 -0.318816D+01
      6   0.529401D+01  0.196193D+01  0.103984D+02 -0.345861D+01  0.462913D+00
                 6             7             8             9            10 
      1   0.101899D+01  0.636157D+01  0.655640D+01  0.158647D+01 -0.135461D+02
      2   0.497871D+00 -0.461483D+01 -0.550329D+01 -0.843145D+01  0.638137D+01
      3  -0.151686D+01 -0.174673D+01 -0.105311D+01  0.684498D+01  0.716478D+01
      4  -0.417795D+01  0.478692D+01 -0.213491D+01  0.157480D+02  0.492632D+01
      5   0.166216D+02  0.235946D+02  0.181809D+02  0.229862D+01  0.106179D+02
      6   0.559400D+01  0.101609D+02  0.160110D+02 -0.201525D+01 -0.823132D+00
                11            12            13            14            15 
      1   0.280860D+01  0.753951D+01 -0.134710D+02 -0.250295D+02 -0.241445D+01
      2  -0.416127D+00 -0.383633D+01  0.121614D+02  0.264404D+02  0.395083D+01
      3  -0.239247D+01 -0.370318D+01  0.130961D+01 -0.141083D+01 -0.153638D+01
      4   0.235086D+02 -0.104492D+01 -0.282203D+02  0.892896D+01  0.351782D+01
      5  -0.161873D+01  0.203788D+02 -0.606953D+01  0.282832D+01 -0.372115D+01
      6  -0.887614D+00 -0.196309D+01  0.316420D+01 -0.815040D+00 -0.694599D+01
                16            17            18            19            20 
      1   0.104904D+02 -0.409334D+01  0.138278D+02  0.151178D+02  0.211757D+02
      2  -0.352099D+01  0.269459D+01 -0.199993D+02 -0.135121D+02 -0.150645D+02
      3  -0.696946D+01  0.139875D+01  0.617144D+01 -0.160574D+01 -0.611123D+01
      4  -0.666333D+01 -0.920970D+00 -0.182685D+01  0.127973D+02 -0.137193D+02
      5   0.364330D+02 -0.383523D+01 -0.677727D+01  0.118716D+01 -0.436363D+01
      6  -0.954603D-01  0.515034D+01 -0.175776D+01 -0.285830D+01  0.499955D+01
                21            22            23            24            25 
      1  -0.828146D+00 -0.208838D+02  0.131618D+02  0.719227D+00 -0.216380D+00
      2   0.360291D+00  0.207558D+02 -0.226653D+02 -0.400208D+01  0.207771D+01
      3   0.467855D+00  0.128000D+00  0.950350D+01  0.328285D+01 -0.186133D+01
      4  -0.393700D+01  0.939072D+01  0.389712D+01  0.244001D+01 -0.426231D+01
      5  -0.295889D+01 -0.105839D+01  0.286042D+01 -0.138955D+02  0.118030D+02
      6  -0.702716D+00  0.171260D+01 -0.504074D+01  0.796743D+01 -0.719468D+01
                26            27            28            29            30 
      1  -0.212387D+01 -0.401442D+01 -0.963213D+01 -0.272073D+02 -0.740090D+00
      2  -0.266206D+01 -0.648897D+01  0.812872D+01  0.206246D+02 -0.155825D+01
      3   0.478593D+01  0.105034D+02  0.150341D+01  0.658272D+01  0.229834D+01
      4   0.643089D+01 -0.155466D+02 -0.107060D+02 -0.744848D+01  0.128835D-01
      5  -0.154445D+02 -0.188789D+01 -0.175455D+01  0.507159D+00 -0.133664D+01
      6   0.130592D+02  0.224217D+01  0.723026D-01 -0.369451D+01  0.309037D+01
                31            32            33            34            35 
      1  -0.110688D+02 -0.827497D+01 -0.586686D+00  0.191005D+01  0.747860D+00
      2   0.233550D+00  0.795760D+01  0.296373D+00 -0.282094D+01 -0.551638D+00
      3   0.108352D+02  0.317376D+00  0.290313D+00  0.910886D+00 -0.196223D+00
      4   0.734037D+01 -0.989014D+01 -0.230074D+01 -0.549543D+00  0.138347D+01
      5  -0.260499D+01 -0.233975D+01 -0.845877D+00  0.135767D+01 -0.307544D+01
      6  -0.743760D+01 -0.164422D+01  0.323271D+01  0.217127D+01  0.106358D+02
                36            37            38            39            40 
      1  -0.125793D+02 -0.246081D+02  0.456731D+01 -0.411975D+00 -0.338824D+01
      2   0.246593D+01  0.881425D+01 -0.104686D+01  0.458008D+00  0.574090D+01
      3   0.101134D+02  0.157938D+02 -0.352045D+01 -0.460330D-01 -0.235267D+01
      4  -0.204381D+01 -0.627412D+01  0.696883D+01  0.734474D+00 -0.109042D+02
      5   0.211600D+01 -0.688819D+01 -0.270440D+00  0.118971D+01  0.357758D+00
      6  -0.132079D+01  0.629607D+00 -0.173370D+01 -0.196344D+01  0.524470D+01
                41            42            43            44            45 
      1  -0.468668D+01  0.943364D+00  0.429987D+01 -0.178745D+01 -0.878381D+01
      2   0.127813D+02  0.154362D+01 -0.779343D+00  0.179557D+01 -0.331932D+01
      3  -0.809460D+01 -0.248698D+01 -0.352053D+01 -0.812520D-02  0.121031D+02
      4   0.725633D+01  0.356141D+01 -0.170855D+01  0.407405D+01 -0.139689D+01
      5   0.257703D+01  0.219196D+00  0.386954D+01  0.100047D+01  0.553670D-02
      6   0.847541D+00 -0.694870D+00 -0.138664D+01  0.451565D+01  0.911959D+00
                46            47            48            49            50 
      1   0.797229D+01  0.121348D+02 -0.100041D+01  0.331628D+01  0.832302D+01
      2  -0.548138D+01 -0.110953D+02  0.158837D+01  0.535776D+01 -0.162470D+02
      3  -0.249091D+01 -0.103947D+01 -0.587965D+00 -0.867403D+01  0.792398D+01
      4   0.124086D+02 -0.196750D+02 -0.252652D+01  0.158267D+02  0.124571D+02
      5   0.173405D+00 -0.248349D+01 -0.629897D+01  0.166015D+01  0.580478D+00
      6  -0.420928D+01  0.289948D+01 -0.845542D+01  0.517172D+00 -0.460694D+01
                51            52            53            54            55 
      1   0.180601D+01 -0.666774D+00 -0.298703D+00 -0.162219D+02  0.184570D+02
      2  -0.361515D+01  0.170967D+01 -0.312342D+01  0.355503D+01 -0.564865D+01
      3   0.180914D+01 -0.104290D+01  0.342213D+01  0.126669D+02 -0.128084D+02
      4   0.304048D+00  0.230839D+01  0.420411D+01  0.696811D+01  0.103572D+02
      5   0.238085D+01  0.124678D+01  0.702170D+01  0.521232D+01  0.432121D+01
      6   0.828713D+01 -0.237083D+01  0.170384D+02  0.488592D+01 -0.226897D+00
                56            57            58            59            60 
      1   0.100847D+01 -0.167194D+01  0.504775D+01 -0.845525D+01  0.156160D+01
      2   0.214346D+01 -0.386088D+01 -0.343939D+00  0.447432D+00  0.126295D+01
      3  -0.315192D+01  0.553282D+01 -0.470381D+01  0.800781D+01 -0.282455D+01
      4  -0.123043D+02  0.426360D+00 -0.229446D+02 -0.632296D+01 -0.845579D+01
      5   0.129935D+01 -0.106610D+02  0.223144D+01 -0.833258D+01  0.390210D+01
      6  -0.354541D+01  0.345801D+01 -0.572722D+01  0.322498D+01 -0.250587D+01
                61            62            63            64            65 
      1  -0.120818D+02  0.184569D+01  0.490980D+01 -0.175361D+02 -0.191970D+02
      2  -0.108110D+02  0.387035D+01  0.126263D+02  0.226206D+01  0.104852D+02
      3   0.228927D+02 -0.571604D+01 -0.175361D+02  0.152740D+02  0.871186D+01
      4   0.122627D+01 -0.135341D+02  0.552935D+01 -0.232701D+02 -0.676741D+01
      5  -0.168247D+02  0.350139D+01  0.378481D+02  0.152186D+02  0.562348D+01
      6   0.637530D+01 -0.660631D+00 -0.864163D+01  0.663873D+01  0.311243D+01
                66            67            68            69            70 
      1   0.988838D+01 -0.208333D+02  0.750541D+00  0.201155D+01  0.161577D+02
      2  -0.188481D+01  0.112535D+02  0.208182D+01  0.745299D+00  0.367172D-01
      3  -0.800357D+01  0.957980D+01 -0.283236D+01 -0.275685D+01 -0.161944D+02
      4   0.714717D+01 -0.404843D+01  0.133697D+02  0.742988D+01  0.139618D+02
      5  -0.798717D+01  0.689271D+01  0.620223D+01  0.151882D+01 -0.149182D+02
      6  -0.359347D+01  0.450740D+01  0.606227D+01  0.181969D+01 -0.717374D+01
                71            72            73            74            75 
      1   0.734854D+01 -0.929618D+01 -0.641660D+01  0.106580D+02 -0.449837D+01
      2  -0.187703D+01  0.169006D+02  0.992499D+01 -0.606052D+01  0.473135D+01
      3  -0.547151D+01 -0.760443D+01 -0.350839D+01 -0.459752D+01 -0.232984D+00
      4   0.102363D+02 -0.704358D+01  0.448219D+01  0.520603D+01  0.373131D-01
      5  -0.260524D+01 -0.288366D+02 -0.153885D+01  0.100354D+01 -0.128705D+01
      6   0.355968D+01 -0.109350D+02  0.104520D+01  0.639576D+01 -0.585101D+00
                76            77            78            79            80 
      1   0.230982D+02  0.299928D+02  0.363624D+00 -0.987592D+01 -0.140153D+01
      2  -0.174608D+02 -0.322493D+02 -0.832553D+01  0.635686D+01 -0.983322D+01
      3  -0.563738D+01  0.225653D+01  0.796191D+01  0.351905D+01  0.112348D+02
      4   0.246166D+01 -0.609722D+01  0.702760D-02 -0.117474D+00  0.203087D+01
      5   0.238228D+01  0.690297D+00 -0.674602D+01 -0.162107D+01 -0.995112D+01
      6   0.511482D+01 -0.593768D+01 -0.222807D+02 -0.106427D+02 -0.411353D+02
                81            82            83            84            85 
      1   0.291338D+02  0.257021D+02  0.156999D+02 -0.294146D+00  0.103658D+02
      2  -0.273303D+02 -0.459784D+01  0.125273D+01  0.936086D-01  0.743533D+01
      3  -0.180342D+01 -0.211043D+02 -0.169526D+02  0.200538D+00 -0.178011D+02
      4  -0.755655D+01  0.383521D+02  0.342626D+02 -0.106270D+01  0.374769D+02
      5   0.814789D+01 -0.437520D+00 -0.616735D+00  0.557589D+01  0.722899D+00
      6   0.174064D+02 -0.117511D+01 -0.124016D+01  0.320180D+01 -0.280284D+00
                86            87            88            89            90 
      1   0.471837D+01  0.137248D+00 -0.181839D+01 -0.140245D+01  0.299414D+00
      2   0.174104D+02 -0.323013D+00  0.929318D+00  0.984889D+00  0.107403D+01
      3  -0.221288D+02  0.185765D+00  0.889072D+00  0.417557D+00 -0.137344D+01
      4   0.462086D+02 -0.624923D-01 -0.163308D+01 -0.784734D+00  0.228205D+01
      5   0.799170D+00  0.460679D+01  0.141193D+01  0.684339D+00 -0.394980D+00
      6  -0.564665D+00  0.521091D+01  0.104699D+01  0.144935D+01 -0.170157D+00
                91            92            93            94            95 
      1   0.102452D+03 -0.100415D+02 -0.914063D+01 -0.983602D+01  0.100532D+02
      2  -0.597231D+02  0.546906D+01  0.634767D+01  0.489458D+01 -0.490403D+01
      3  -0.427294D+02  0.457244D+01  0.279296D+01  0.494144D+01 -0.514920D+01
      4  -0.143887D+02  0.969061D+01  0.140437D+01  0.165297D+02 -0.476207D+01
      5  -0.133069D+02  0.143929D+01  0.108158D+02  0.273416D+01 -0.171375D+01
      6   0.246007D+00 -0.686315D+00 -0.680463D+00 -0.121042D+01  0.317252D+00
                96            97            98            99           100 
      1   0.153820D+01 -0.121289D+02  0.173551D+01  0.347767D+01  0.586244D+01
      2  -0.115486D+01  0.728341D+01 -0.881802D+00 -0.202594D+01  0.230647D+01
      3  -0.383342D+00  0.484544D+01 -0.853703D+00 -0.145174D+01 -0.816891D+01
      4  -0.176077D+01  0.306352D+01 -0.141793D+01 -0.102552D+01 -0.179964D+02
      5  -0.156629D+01  0.318534D+01 -0.169738D+00 -0.205008D+01 -0.212853D+01
      6   0.175883D+01 -0.316738D+00  0.681785D+00  0.490394D+00  0.179547D+01
               101           102           103           104           105 
      1  -0.447607D+01 -0.587942D+00  0.167557D+00 -0.144545D+02 -0.154105D+01
      2  -0.422801D+01  0.435903D-01 -0.103497D+02  0.352264D+02  0.237980D+01
      3   0.870409D+01  0.544351D+00  0.101821D+02 -0.207719D+02 -0.838749D+00
      4   0.216297D+02  0.271641D+01  0.251180D+02 -0.473780D+02 -0.461856D+01
      5   0.239041D+01  0.337842D+01  0.229484D+01 -0.353164D+01 -0.444768D+01
      6  -0.217218D+01 -0.231578D+01 -0.253846D+01  0.627918D+01  0.714897D+01
               106           107           108           109           110 
      1  -0.716029D+00 -0.101168D+01 -0.166880D+01 -0.433606D+01  0.810190D+01
      2  -0.598934D+00  0.301019D+01  0.284223D+01  0.657914D+01 -0.100131D+02
      3   0.131496D+01 -0.199852D+01 -0.117343D+01 -0.224308D+01  0.191116D+01
      4   0.401722D+01 -0.582814D+01 -0.223714D+01 -0.334322D+01  0.780844D+01
      5   0.145114D+01 -0.141172D+01 -0.115951D+01  0.363444D+00 -0.324373D-01
      6  -0.163146D+01  0.355758D+01  0.151235D+01  0.120384D+01 -0.223846D+01
               111           112           113           114           115 
      1   0.150600D+01  0.654957D+01 -0.369554D+02 -0.399345D+01  0.995813D+00
      2  -0.996370D+00 -0.847390D+01  0.519091D+02  0.406750D+01 -0.112378D+01
      3  -0.509632D+00  0.192434D+01 -0.149537D+02 -0.740498D-01  0.127963D+00
      4   0.318562D+00  0.599119D+01  0.295309D+01  0.524150D+00  0.362910D+00
      5   0.107141D+01 -0.559706D-01  0.178930D+01  0.358116D+00  0.496515D+00
      6  -0.178555D+01 -0.119723D+01  0.755852D+01  0.735127D+01 -0.524098D+00
               116           117           118           119           120 
      1  -0.339849D+01 -0.180270D+01  0.483360D+01 -0.837699D+00 -0.407688D+01
      2   0.420034D+01  0.239152D+01 -0.830883D+01  0.283986D+00  0.600178D+01
      3  -0.801850D+00 -0.588826D+00  0.347522D+01  0.553713D+00 -0.192490D+01
      4  -0.324757D+00 -0.161461D+01 -0.391990D+01  0.693173D+01  0.172300D+01
      5  -0.621995D+00 -0.626601D+00 -0.112087D+02  0.111999D+01  0.154455D+02
      6   0.319626D+01  0.142761D+01  0.208805D+01 -0.148713D+00 -0.174613D+01
               121           122           123           124           125 
      1  -0.388496D+00 -0.170609D+01 -0.358211D+00 -0.964478D+00 -0.914346D+00
      2  -0.550592D+00 -0.844452D+00  0.200590D+00  0.129340D+02 -0.117730D+01
      3   0.939088D+00  0.255054D+01  0.157621D+00 -0.119696D+02  0.209165D+01
      4   0.972069D+01 -0.281077D+01 -0.433903D+01  0.437347D+01 -0.571595D+01
      5   0.505594D+00 -0.424498D+01 -0.159628D+01  0.232389D+02 -0.378251D+01
      6  -0.163356D+01  0.111868D+01  0.803496D+01 -0.409927D+01  0.529682D+01
               126           127           128           129           130 
      1  -0.135206D+02 -0.630797D+02  0.954028D+01  0.465013D+01 -0.315255D+01
      2  -0.236006D+02  0.360612D+02 -0.136973D+02 -0.484455D+01 -0.446809D+01
      3   0.371213D+02  0.270185D+02  0.415701D+01  0.194415D+00  0.762064D+01
      4  -0.376694D+01  0.145960D+02  0.152486D+02 -0.360281D+01  0.217838D+02
      5  -0.403331D+02  0.509003D+01 -0.152763D+01  0.878875D+01 -0.407390D+01
      6   0.923612D+01 -0.701399D+01  0.247748D+01 -0.578216D+01  0.423061D+01
               131           132           133           134           135 
      1   0.249318D+02  0.553793D+01  0.966628D+01  0.325605D+01  0.166934D+02
      2  -0.280027D+02 -0.118455D+02 -0.170095D+01 -0.132473D+02  0.169519D-01
      3   0.307086D+01  0.630757D+01 -0.796532D+01  0.999126D+01 -0.167104D+02
      4   0.409416D+01  0.131007D+02 -0.973607D+01  0.155281D+02 -0.289984D+01
      5   0.155650D+02  0.448526D+00  0.758169D+01  0.208534D+01 -0.273283D+02
      6  -0.137876D+02 -0.210418D+00 -0.449655D+01 -0.155100D+01  0.184967D+02
               136           137           138           139           140 
      1   0.514162D+02  0.147725D+02 -0.984213D+01  0.116446D+02  0.609814D+01
      2  -0.230119D+02 -0.351642D+01  0.447825D+01 -0.127563D+01  0.276769D+01
      3  -0.284043D+02 -0.112561D+02  0.536388D+01 -0.103690D+02 -0.886584D+01
      4   0.360929D+02  0.208307D+02 -0.710105D+01  0.209402D+02  0.147457D+02
      5  -0.145232D+02 -0.466508D+01  0.110115D+02 -0.447680D+01 -0.528845D+01
      6  -0.606790D+01 -0.301675D+01  0.444031D+01 -0.322418D+01 -0.315704D+01
               141           142           143           144           145 
      1  -0.176764D+01 -0.161395D+02 -0.334134D+01  0.746771D+01  0.747688D+01
      2  -0.593757D+00  0.824807D+01 -0.358785D-01 -0.630921D+01 -0.649808D+01
      3   0.236140D+01  0.789140D+01  0.337722D+01 -0.115850D+01 -0.978795D+00
      4  -0.584503D+01 -0.128337D+02 -0.980361D+01  0.819706D+01  0.547262D+01
      5   0.344943D+01  0.156346D+02  0.587790D+01 -0.698355D+01  0.831624D+01
      6   0.332561D+01  0.708064D+01  0.398762D+01 -0.349385D+01  0.249534D+01
               146           147           148           149           150 
      1   0.362811D+01  0.475077D+01  0.410607D+00 -0.105340D+01 -0.171604D+01
      2  -0.207618D+01 -0.495044D+01  0.137037D+01 -0.130104D+01  0.245835D+01
      3  -0.155193D+01  0.199668D+00 -0.178098D+01  0.235444D+01 -0.742312D+00
      4   0.267578D+01  0.213114D+01  0.407775D+01 -0.995254D+00  0.387857D+01
      5   0.482210D+00  0.959189D+01 -0.146080D+01  0.382080D+01 -0.221491D+01
      6   0.105544D+01  0.177053D+01  0.115564D+01  0.113889D+01  0.490804D+01
               151           152           153           154           155 
      1   0.784744D+01 -0.220209D+01 -0.152248D+01  0.339531D+00  0.528403D+00
      2  -0.114356D+02  0.172952D+01 -0.193607D+02 -0.126117D+01 -0.334716D+00
      3   0.358815D+01  0.472567D+00  0.208832D+02  0.921640D+00 -0.193687D+00
      4   0.458195D+01  0.730618D+01  0.695747D+01  0.328196D+01  0.699270D+01
      5   0.191556D+02  0.361350D+01  0.358758D+02 -0.229848D+01 -0.366050D+01
      6   0.668885D+01  0.478194D+01  0.159291D+02 -0.647944D+01 -0.205213D+01
               156           157           158           159           160 
      1  -0.643314D+00 -0.495418D+01 -0.238671D+02  0.117615D+02  0.424682D+01
      2  -0.148954D+00  0.591814D+01  0.273347D+02 -0.109279D+02 -0.297594D+01
      3   0.792269D+00 -0.963963D+00 -0.346758D+01 -0.833661D+00 -0.127088D+01
      4  -0.553681D+01  0.521936D+01  0.849247D+01 -0.432215D+01 -0.909743D+01
      5   0.641891D+01 -0.240039D+01 -0.494285D+01  0.445163D+01  0.693074D+01
      6   0.196769D+01 -0.438372D+01 -0.186856D+02  0.182694D+02  0.930149D+01
               161           162           163           164           165 
      1   0.227147D+02 -0.264128D+02 -0.505376D+00  0.438847D+01  0.236222D+01
      2  -0.179526D+02  0.126105D+02  0.270152D+01 -0.503136D+01 -0.191534D+01
      3  -0.476212D+01  0.138023D+02 -0.219614D+01  0.642889D+00 -0.446873D+00
      4  -0.905972D+01  0.741964D+01  0.120364D+01  0.802150D+01  0.382757D+01
      5   0.975793D+01 -0.117320D+02  0.104036D+01  0.182076D+01  0.272196D+01
      6   0.332683D+02 -0.356740D+02  0.487409D+01 -0.142944D+01 -0.767055D+00
               166           167           168           169           170 
      1  -0.282949D+01 -0.366422D+02 -0.113067D+02  0.490024D+00 -0.198113D+02
      2   0.447468D+01  0.530987D+02  0.164440D+02  0.127932D+01  0.263081D+02
      3  -0.164519D+01 -0.164565D+02 -0.513727D+01 -0.176935D+01 -0.649681D+01
      4   0.687674D+01  0.105424D+02  0.312318D+01  0.543539D+01  0.570924D+01
      5   0.159613D+01  0.372382D+01  0.332656D+01  0.345141D+01  0.540044D+01
      6   0.173349D+01  0.221798D+02  0.163594D+02  0.395664D+01  0.259190D+02
               171           172           173           174           175 
      1  -0.164565D+02  0.385568D+01 -0.249743D+01  0.588754D+01  0.110712D+01
      2   0.153283D+02 -0.419660D+01  0.304405D+01 -0.107964D+01 -0.793561D+00
      3   0.112819D+01  0.340914D+00 -0.546621D+00 -0.480789D+01 -0.313559D+00
      4   0.434559D+01 -0.381121D+00 -0.215575D+01 -0.187246D+01 -0.712541D+00
      5   0.236937D+01  0.220464D+01  0.143884D+00 -0.439473D+00  0.584347D+00
      6   0.151108D+02 -0.183418D+01 -0.160219D+01  0.338041D+01  0.850753D-02
               176           177           178           179           180 
      1  -0.620875D+01  0.233426D+01  0.622129D+01  0.376759D+01 -0.183224D+02
      2   0.436740D+01 -0.252155D+01 -0.358478D+01 -0.262105D+01 -0.938869D+01
      3   0.184136D+01  0.187286D+00 -0.263650D+01 -0.114654D+01  0.277111D+02
      4  -0.144613D+01  0.264132D+01 -0.645614D+01  0.728789D+01 -0.295116D+01
      5   0.222533D+01 -0.461720D+00  0.762243D+01 -0.626078D+01  0.334927D+02
      6  -0.234116D+01  0.620386D+01 -0.191671D+01  0.925383D+01 -0.262083D+02
               181           182           183           184           185 
      1   0.900344D+02 -0.867830D+01 -0.352701D+01  0.572915D+01  0.452241D+01
      2  -0.463786D+02  0.105436D+01  0.159964D+01 -0.598016D+01  0.461471D+00
      3  -0.436558D+02  0.762394D+01  0.192737D+01  0.251006D+00 -0.498388D+01
      4  -0.375454D+02  0.160768D+02  0.828643D+00  0.879821D+01 -0.373766D+01
      5   0.206157D+01 -0.524659D+00  0.105359D+02  0.505936D+00 -0.174721D+01
      6   0.205844D+01  0.877336D+00 -0.407737D+01  0.361694D+00  0.127880D+01
               186           187           188           189           190 
      1  -0.909255D+00 -0.750188D+01 -0.358554D+00  0.603899D+01  0.272880D+01
      2   0.145128D+01  0.397056D+01  0.208536D+01 -0.513142D+01  0.119129D+01
      3  -0.542029D+00  0.353132D+01 -0.172680D+01 -0.907570D+00 -0.392009D+01
      4  -0.186822D+01  0.397813D+01 -0.384631D+01 -0.300894D+01 -0.200689D+01
      5   0.944611D+00  0.115904D+02 -0.176939D+01 -0.337421D+00 -0.162528D+01
      6   0.754370D+00 -0.349503D+01  0.191098D+01 -0.681880D+00  0.224715D+01
               191           192           193           194           195 
      1  -0.858200D+01 -0.244753D+01 -0.546766D+01 -0.283386D+02 -0.613062D+01
      2   0.962219D+01  0.239520D+01  0.179976D+01  0.492115D+02  0.999202D+01
      3  -0.104019D+01  0.523314D-01  0.366790D+01 -0.208729D+02 -0.386140D+01
      4  -0.940845D-01  0.138459D+01  0.894396D+01 -0.333799D+02 -0.626256D+01
      5  -0.401458D+00 -0.132182D+01 -0.570576D+00 -0.833281D+01 -0.673287D+01
      6   0.668163D+00  0.271024D+01 -0.144791D+00  0.759782D+01  0.901023D+01
               196           197           198 
      1  -0.425384D+01 -0.681779D+01 -0.789909D+01
      2   0.146482D+01  0.117971D+02  0.650868D+01
      3   0.278902D+01 -0.497929D+01  0.139040D+01
      4   0.496157D+01 -0.108200D+02 -0.452887D+01
      5   0.645182D+00 -0.634056D+01 -0.240420D+01
      6   0.417517D+00  0.947845D+01  0.473511D+01
 Leave Link  716 at Thu Jul  8 21:25:42 2021, MaxMem= 10737418240 cpu:               1.1 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l9999.exe)
 AllDun F.D. properties on file 20721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) frequency  1    0.085645:
                 1             2             3 
      1   0.147336D+03  0.185567D+01 -0.348524D+01
      2   0.185567D+01  0.129405D+03  0.148588D+01
      3  -0.348524D+01  0.148588D+01  0.825990D+02
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.085645:
                 1             2             3 
      1   0.439692D+00  0.959180D+00  0.196300D+01
      2   0.103121D+02 -0.566690D+01  0.126949D+02
      3   0.448775D+00  0.320528D+02  0.520413D+01
 Property number 4 -- D-Q polarizability frequency  1    0.085645:
                 1             2             3 
      1  -0.739893D+02 -0.151899D+02  0.137173D+02
      2   0.387046D+02  0.160040D+01 -0.137562D+02
      3   0.352847D+02  0.135895D+02  0.388817D-01
      4  -0.275242D+02 -0.332348D+02 -0.108300D+02
      5   0.149339D+02 -0.138474D+02  0.323531D+02
      6  -0.723586D+01 -0.125287D+01  0.731317D+00
 AllDun F.D. properties on file 20722 Mask=       B NFrqRd=     1 NDeriv=    66 ND12= 1 LenFil=    2379:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.274745D+00 -0.991059D+00 -0.760802D+00 -0.517803D+01 -0.849827D-01
      2  -0.991059D+00 -0.234371D+01 -0.669696D+00 -0.849827D-01 -0.241399D+01
      3  -0.760802D+00 -0.669696D+00 -0.166928D+01  0.536409D+00  0.537188D+00
                 6             7             8             9            10 
      1   0.536409D+00 -0.127094D+01 -0.116130D+00 -0.351903D+01 -0.458644D+01
      2   0.537188D+00 -0.116130D+00  0.410147D+00 -0.381165D+01  0.760261D+00
      3  -0.299240D+01 -0.351903D+01 -0.381165D+01 -0.193151D-01 -0.652399D+00
                11            12            13            14            15 
      1   0.760261D+00 -0.652399D+00  0.152116D+01  0.222966D+01  0.321305D+00
      2  -0.266749D+01  0.218451D-01  0.222966D+01  0.230589D+01 -0.409139D+00
      3   0.218451D-01 -0.305814D+01  0.321305D+00 -0.409139D+00  0.942836D+00
                16            17            18            19            20 
      1  -0.691389D+00  0.635175D+00 -0.526390D+01  0.909929D+00 -0.290783D+01
      2   0.635175D+00  0.273150D+00  0.691568D+00 -0.290783D+01 -0.356950D+01
      3  -0.526390D+01  0.691568D+00  0.145900D+01 -0.258797D+00  0.501833D+00
                21            22            23            24            25 
      1  -0.258797D+00  0.511129D+01 -0.366558D+00 -0.382540D-01  0.174581D+00
      2   0.501833D+00 -0.366558D+00  0.409690D+00 -0.467934D+00  0.937832D+00
      3  -0.569120D+00 -0.382540D-01 -0.467934D+00  0.265318D+01 -0.234999D+01
                26            27            28            29            30 
      1   0.937832D+00 -0.234999D+01  0.795229D+00  0.269264D+01 -0.274895D+00
      2  -0.526184D+00  0.346363D+01  0.269264D+01  0.706098D+01 -0.160221D+00
      3   0.346363D+01  0.145536D+01 -0.274895D+00 -0.160221D+00  0.194627D+01
                31            32            33            34            35 
      1   0.115214D+02  0.422049D+01 -0.907754D+00  0.164371D+01 -0.285208D+00
      2   0.422049D+01  0.631953D+01 -0.519789D+00 -0.285208D+00 -0.287044D+00
      3  -0.907754D+00 -0.519789D+00  0.154004D+01  0.149605D+01  0.296052D+01
                36            37            38            39            40 
      1   0.149605D+01  0.148039D+02 -0.172945D+01 -0.186067D+01 -0.599777D+01
      2   0.296052D+01 -0.172945D+01  0.365250D+01  0.646644D-01 -0.315640D+01
      3  -0.981834D-01 -0.186067D+01  0.646644D-01  0.235530D+01 -0.102178D+00
                41            42            43            44            45 
      1  -0.315640D+01 -0.102178D+00 -0.143974D+01 -0.444660D+00  0.308203D+01
      2  -0.419933D+00  0.518917D+00 -0.444660D+00  0.415877D+00 -0.834943D+00
      3   0.518917D+00  0.338543D+00  0.308203D+01 -0.834943D+00 -0.136161D+01
                46            47            48            49            50 
      1  -0.154357D+01  0.323572D+01  0.370619D+00 -0.558529D+01  0.521285D+00
      2   0.323572D+01  0.199011D+01 -0.329997D+00  0.521285D+00 -0.193423D+01
      3   0.370619D+00 -0.329997D+00  0.112965D+01  0.177696D+00  0.372397D+00
                51            52            53            54            55 
      1   0.177696D+00  0.913175D-01 -0.508875D+00  0.391076D+00 -0.363358D+01
      2   0.372397D+00 -0.508875D+00  0.469045D-01 -0.394509D+01  0.236846D+01
      3  -0.241878D+01  0.391076D+00 -0.394509D+01 -0.119736D+01  0.103955D+01
                56            57            58            59            60 
      1   0.236846D+01  0.103955D+01  0.303496D+01 -0.354450D+01  0.321069D+00
      2  -0.244663D+01  0.208262D+00 -0.354450D+01 -0.220550D+01 -0.167549D+01
      3   0.208262D+00 -0.230440D+01  0.321069D+00 -0.167549D+01  0.766830D+00
                61            62            63            64            65 
      1   0.284629D+01  0.247968D+00 -0.355487D+01 -0.420324D+01 -0.383081D+01
      2   0.247968D+00 -0.240551D+01  0.415550D+00 -0.383081D+01  0.116903D+01
      3  -0.355487D+01  0.415550D+00  0.907770D+01  0.228224D+01  0.749521D+00
                66            67            68            69            70 
      1   0.228224D+01 -0.384357D+01  0.780746D+00  0.953332D+00  0.355943D+01
      2   0.749521D+00  0.780746D+00  0.284878D+01  0.144148D+01  0.165944D+01
      3  -0.146698D+01  0.953332D+00  0.144148D+01  0.513605D+00 -0.261638D+01
                71            72            73            74            75 
      1   0.165944D+01 -0.261638D+01 -0.227677D+01  0.966253D+00 -0.160511D+00
      2   0.184304D+01  0.167759D+00  0.966253D+00 -0.208856D+01  0.982298D+00
      3   0.167759D+00 -0.644609D+01 -0.160511D+00  0.982298D+00 -0.175327D+00
                76            77            78            79            80 
      1   0.555018D+00 -0.367540D+01  0.968374D+00  0.532283D+00  0.174738D+01
      2  -0.367540D+01 -0.805255D+01 -0.549233D+00  0.174738D+01 -0.225086D+00
      3   0.968374D+00 -0.549233D+00 -0.382449D+01 -0.147072D+01 -0.631181D+01
                81            82            83            84            85 
      1  -0.147072D+01 -0.574599D+01 -0.431960D+01  0.184989D+00 -0.405543D+01
      2  -0.631181D+01 -0.431960D+01 -0.377957D+01  0.173568D+00 -0.473533D+01
      3   0.367162D+01  0.184989D+00  0.173568D+00 -0.535751D+00 -0.395961D-01
                86            87            88            89            90 
      1  -0.473533D+01 -0.395961D-01  0.352832D+00  0.185040D+00  0.621916D-02
      2  -0.661309D+01  0.181819D-02  0.185040D+00  0.161122D-01  0.244978D-01
      3   0.181819D-02 -0.641275D+00  0.621916D-02  0.244978D-01  0.371704D-02
                91            92            93            94            95 
      1  -0.137099D+02  0.139838D+01  0.144572D+01  0.151610D+01 -0.176798D+01
      2   0.139838D+01 -0.857606D+00 -0.163400D+00 -0.176798D+01  0.528629D+00
      3   0.144572D+01 -0.163400D+00 -0.990864D+00 -0.328066D+00  0.208858D+00
                96            97            98            99           100 
      1  -0.328066D+00  0.171581D+01 -0.353559D+00 -0.103216D+00 -0.223831D+01
      2   0.208858D+00 -0.353559D+00  0.187239D+00  0.445291D-01  0.248439D+01
      3   0.204161D+00 -0.103216D+00  0.445291D-01  0.101269D+00  0.364018D+00
               101           102           103           104           105 
      1   0.248439D+01  0.364018D+00  0.234563D+01 -0.377173D+01 -0.384969D+00
      2  -0.269123D+01 -0.401104D+00 -0.377173D+01  0.929455D+01  0.944726D+00
      3  -0.401104D+00 -0.395787D+00 -0.384969D+00  0.944726D+00  0.873230D+00
               106           107           108           109           110 
      1   0.377780D+00 -0.553147D+00 -0.158637D+00  0.125635D+01 -0.172670D+01
      2  -0.553147D+00  0.115186D+01  0.256312D+00 -0.172670D+01  0.195952D+01
      3  -0.158637D+00  0.256312D+00  0.119171D+00 -0.146783D+00  0.308165D+00
               111           112           113           114           115 
      1  -0.146783D+00 -0.131305D+01  0.179435D+01  0.132519D+00 -0.216995D+00
      2   0.308165D+00  0.179435D+01 -0.944092D+01 -0.922632D+00  0.268000D+00
      3   0.182358D+00  0.132519D+00 -0.922632D+00 -0.832771D+00 -0.120399D-01
               116           117           118           119           120 
      1   0.268000D+00 -0.120399D-01  0.257468D+01 -0.620313D+00 -0.206419D+01
      2  -0.902523D+00 -0.140197D+00 -0.620313D+00  0.701664D+00  0.112059D+00
      3  -0.140197D+00 -0.167729D+00 -0.206419D+01  0.112059D+00  0.188523D+01
               121           122           123           124           125 
      1  -0.101376D+01  0.156805D+01  0.152511D+00 -0.531707D+01  0.540129D+00
      2   0.156805D+01 -0.367973D+00 -0.104935D+01  0.540129D+00 -0.117318D+01
      3   0.152511D+00 -0.104935D+01 -0.386520D+00  0.392650D+01 -0.713195D+00
               126           127           128           129           130 
      1   0.392650D+01 -0.813572D+01 -0.798261D+00  0.142807D+01 -0.395491D+01
      2  -0.713195D+00 -0.798261D+00  0.317705D+01 -0.353530D+00  0.326997D+01
      3  -0.969917D+01  0.142807D+01 -0.353530D+00  0.173902D+01 -0.527811D+00
               131           132           133           134           135 
      1   0.326997D+01 -0.527811D+00  0.228811D+01 -0.117155D+01  0.118632D+01
      2   0.292317D+01  0.285046D+01 -0.117155D+01  0.337671D+01  0.744159D+00
      3   0.285046D+01  0.225430D-01  0.118632D+01  0.744159D+00 -0.645646D+01
               136           137           138           139           140 
      1   0.948191D+01  0.338814D+01 -0.188604D+01  0.298094D+01  0.227654D+01
      2   0.338814D+01  0.200119D+01 -0.659514D+00  0.227654D+01  0.178360D+01
      3  -0.188604D+01 -0.659514D+00  0.133828D+01 -0.646764D+00 -0.813859D+00
               141           142           143           144           145 
      1  -0.646764D+00 -0.389805D+01 -0.137195D+01  0.220806D+01  0.160270D+01
      2  -0.813859D+00 -0.137195D+01 -0.135890D+01  0.865702D+00  0.535411D+00
      3   0.488398D+00  0.220806D+01  0.865702D+00 -0.770189D+00  0.137825D+01
               146           147           148           149           150 
      1   0.535411D+00  0.137825D+01  0.143735D+00  0.485047D+00 -0.183483D+00
      2  -0.214311D-02  0.141525D+00  0.485047D+00 -0.198631D+00  0.772092D+00
      3   0.141525D+00  0.932392D+00 -0.183483D+00  0.772092D+00 -0.399684D+00
               151           152           153           154           155 
      1   0.219506D+01  0.296882D-01  0.303900D+01  0.102651D+01  0.838712D+00
      2   0.296882D-01  0.136660D+01  0.628733D+00  0.838712D+00  0.233246D+00
      3   0.303900D+01  0.628733D+00  0.750004D+01 -0.107416D+01 -0.365107D+00
               156           157           158           159           160 
      1  -0.107416D+01  0.828441D+00  0.166344D+01 -0.645504D+00 -0.277678D+01
      2  -0.365107D+00  0.166344D+01  0.556933D+01 -0.272917D+01 -0.201380D+01
      3   0.371169D+00 -0.645504D+00 -0.272917D+01  0.235718D+01  0.143308D+01
               161           162           163           164           165 
      1  -0.201380D+01  0.143308D+01 -0.245647D+00  0.775027D+00  0.766681D+00
      2  -0.518682D+01  0.501436D+01  0.775027D+00 -0.824549D+00 -0.209852D+00
      3   0.501436D+01 -0.648711D+01  0.766681D+00 -0.209852D+00 -0.157394D+00
               166           167           168           169           170 
      1   0.130417D+01  0.121872D+01  0.179382D+00  0.104597D+01  0.322629D+00
      2   0.121872D+01  0.903529D+01  0.280020D+01  0.322629D+00  0.479395D+01
      3   0.179382D+00  0.280020D+01  0.211280D+01  0.534550D+00  0.363789D+01
               171           172           173           174           175 
      1   0.534550D+00  0.246158D+00  0.790279D-01  0.710600D+00  0.682757D+00
      2   0.363789D+01  0.790279D-01 -0.733663D+00  0.217931D+00 -0.294861D+00
      3   0.209226D+01  0.710600D+00  0.217931D+00 -0.112850D+01  0.808601D-01
               176           177           178           179           180 
      1  -0.294861D+00  0.808601D-01  0.146554D+01 -0.507363D+00  0.622400D+00
      2  -0.605788D+00  0.696005D+00 -0.507363D+00  0.148769D+01 -0.139514D+01
      3   0.696005D+00 -0.714255D-01  0.622400D+00 -0.139514D+01  0.769097D+01
               181           182           183           184           185 
      1   0.131137D+02 -0.193228D+01 -0.319131D+00  0.708318D+00  0.930959D+00
      2  -0.193228D+01  0.140943D+01 -0.735780D-01  0.930959D+00 -0.419796D+00
      3  -0.319131D+00 -0.735780D-01  0.106164D+01  0.741897D-01 -0.384339D+00
               186           187           188           189           190 
      1   0.741897D-01 -0.152022D+01  0.329457D+00  0.125059D+01  0.233334D+00
      2  -0.384339D+00  0.329457D+00 -0.769217D+00 -0.263567D+00 -0.666118D+00
      3   0.152587D+00  0.125059D+01 -0.263567D+00  0.127961D+00 -0.512355D+00
               191           192           193           194           195 
      1  -0.666118D+00 -0.512355D+00 -0.131216D+01  0.438480D+00 -0.932685D-01
      2  -0.135005D+01 -0.956722D-01  0.438480D+00 -0.834605D+01 -0.162321D+01
      3  -0.956722D-01 -0.489778D+00 -0.932685D-01 -0.162321D+01 -0.139859D+01
               196           197           198 
      1  -0.115753D+01  0.423513D+00 -0.127094D+00
      2   0.423513D+00 -0.253481D+01 -0.149963D+01
      3  -0.127094D+00 -0.149963D+01 -0.595840D+00
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.131058D+01 -0.163320D+00 -0.461044D+01  0.106451D+01  0.548735D-01
      2   0.729038D+00  0.933601D+00  0.323810D+01 -0.205334D+00 -0.674865D+00
      3  -0.636697D+01 -0.109576D+02 -0.529821D-01  0.832264D+01 -0.383138D+01
                 6             7             8             9            10 
      1  -0.183894D+01 -0.790023D+01  0.333363D+01  0.119916D+01  0.501316D+00
      2   0.792174D+01 -0.230574D+01  0.113748D+02  0.126366D+01  0.388700D+00
      3   0.203194D+00  0.104898D+01  0.188987D+01 -0.533886D+01  0.376040D+01
                11            12            13            14            15 
      1   0.443968D+00  0.724673D+00  0.113564D+01 -0.126841D+01  0.296584D+01
      2  -0.323984D+00  0.959528D+01 -0.230482D+01 -0.151271D+00 -0.152267D+01
      3  -0.908498D+01 -0.125370D+00  0.107505D+02  0.426617D+01 -0.182852D+01
                16            17            18            19            20 
      1   0.227168D+01  0.117228D+02  0.117019D+01  0.100633D+01 -0.831415D+00
      2   0.837486D+01 -0.312660D+01 -0.340436D+01  0.648857D+00 -0.411239D-02
      3   0.122630D+01 -0.185822D+00  0.198651D+01 -0.280129D+01 -0.157120D+02
                21            22            23            24            25 
      1  -0.222028D+00 -0.100721D+01  0.455377D+00 -0.321694D+01  0.368854D+01
      2  -0.804240D+00  0.799193D+00  0.174415D+01 -0.706110D+01 -0.874890D+01
      3  -0.824613D+00  0.743076D+00  0.645109D+00 -0.464815D+00  0.936870D+00
                26            27            28            29            30 
      1   0.262619D+01 -0.408317D+00 -0.164057D+01  0.192574D+01 -0.148913D+01
      2  -0.971209D+01 -0.100499D+01 -0.330927D+01 -0.126831D+01 -0.108769D+01
      3   0.976268D+00  0.544143D+01 -0.370996D+01  0.527425D+01  0.158280D+01
                31            32            33            34            35 
      1   0.191613D+01  0.322621D+00 -0.126834D+01 -0.183444D+01  0.643180D+01
      2   0.192331D+01 -0.186944D+01 -0.149187D+01 -0.146543D+02 -0.146633D+01
      3   0.992292D+01  0.203853D+02 -0.126828D+01  0.240608D+01 -0.157701D+01
                36            37            38            39            40 
      1   0.512973D+00  0.614031D+00  0.145034D+01  0.160572D+01  0.215577D+01
      2   0.153024D+01 -0.152404D+01 -0.123057D+01 -0.535673D+00 -0.107687D+01
      3   0.333097D+01 -0.837776D+01  0.105721D+02  0.143136D+01  0.960915D+01
                41            42            43            44            45 
      1  -0.281854D-02 -0.360139D+00  0.321535D+01  0.100030D+02 -0.311254D+00
      2   0.348579D+00  0.541499D+00 -0.132468D+02  0.357487D+00  0.134134D+01
      3  -0.580549D+01 -0.142235D+01 -0.291654D+00 -0.546657D+01 -0.242061D+01
                46            47            48            49            50 
      1   0.668708D+00 -0.590008D+00  0.421879D+01 -0.341156D+00 -0.106598D+01
      2  -0.290544D+01  0.198186D+01 -0.285872D+01 -0.139641D+00  0.708848D+00
      3   0.999438D+01 -0.435145D+01 -0.236251D+01  0.788002D+01 -0.645890D+01
                51            52            53            54            55 
      1  -0.374289D+01  0.406272D+01  0.111243D+01 -0.164130D+01 -0.117729D+01
      2   0.216419D+01 -0.138114D+02  0.197837D+01  0.196991D+01 -0.369851D+00
      3   0.101248D+00 -0.406613D+01  0.112582D+01 -0.510119D+01 -0.276177D+01
                56            57            58            59            60 
      1   0.212081D+01 -0.135245D+01  0.297759D+01 -0.112617D+01 -0.148446D+01
      2   0.964745D+00 -0.109826D+01  0.141637D+01 -0.606858D+01  0.101881D+01
      3  -0.232564D+01 -0.102008D+01  0.124032D+02  0.816067D+01  0.463797D+01
                61            62            63            64            65 
      1  -0.349756D+01  0.637725D+01  0.330308D+01 -0.348772D+01 -0.120832D+01
      2  -0.106892D+02  0.101887D+01  0.141064D+02  0.734770D+01  0.356914D+01
      3  -0.345150D+01  0.743539D+01  0.194588D+01  0.872933D+01 -0.134873D+02
                66            67            68            69            70 
      1   0.197863D+01 -0.191598D+01 -0.344584D+01 -0.266174D+01  0.417435D+01
      2  -0.199259D+01  0.414806D+01  0.363614D+01  0.619284D+00 -0.120523D+02
      3   0.156714D+01 -0.857350D+01 -0.603079D+01 -0.346367D+01  0.774482D+00
                71            72            73            74            75 
      1   0.203705D+01  0.647174D+01  0.651562D+00 -0.272960D+01 -0.797108D-01
      2  -0.129891D+01 -0.131679D+02 -0.134355D+01  0.983733D+00  0.204646D+01
      3  -0.453282D+01 -0.350049D+01 -0.800457D+01  0.973660D+00 -0.156919D+01
                76            77            78            79            80 
      1  -0.101814D+01  0.504751D+01  0.724156D+01  0.525890D+01  0.222504D+02
      2   0.401814D+00  0.985968D-01 -0.257098D+01 -0.532105D+01 -0.558230D+01
      3   0.138535D+02 -0.470415D+01  0.408185D+01 -0.736734D+00  0.764193D+01
                81            82            83            84            85 
      1  -0.684504D+01  0.336647D+00  0.385892D+00 -0.243212D+01 -0.115321D+00
      2   0.294197D+01 -0.682065D+00 -0.705713D+00  0.308359D+01 -0.171472D-01
      3   0.188009D+01 -0.135873D+01 -0.489169D+01  0.288516D+00 -0.345091D+01
                86            87            88            89            90 
      1  -0.369997D-01 -0.326186D+01  0.112222D+01  0.167188D+01  0.798949D-01
      2  -0.197539D+00  0.312752D+01 -0.132092D+01 -0.111751D+01 -0.435907D-01
      3  -0.107058D+02  0.115553D+00 -0.298171D+00 -0.722748D+00  0.266615D+00
                91            92            93            94            95 
      1   0.251224D-01 -0.436413D+00  0.631927D+00 -0.179996D+00  0.128278D+00
      2  -0.206500D+01  0.264621D+00  0.628110D+01  0.953823D+00 -0.480612D+00
      3   0.239101D+01 -0.545139D+01 -0.325935D+00 -0.412816D+01  0.182353D+01
                96            97            98            99           100 
      1  -0.445279D+00 -0.543523D+00  0.478989D+00 -0.115963D+00 -0.784941D-01
      2  -0.106866D+01 -0.296154D+01  0.455076D+00 -0.366702D+00 -0.456886D+00
      3   0.583089D+00 -0.678411D+00  0.693460D+00 -0.950577D-01  0.976988D+00
               101           102           103           104           105 
      1   0.243742D+00  0.160090D+01  0.689974D-01  0.468823D+00 -0.431342D+01
      2   0.618608D+00  0.138437D+01  0.363984D+00 -0.174854D+01 -0.267902D+01
      3  -0.265969D+01 -0.398577D+00 -0.978553D+00  0.152848D+02  0.147580D+01
               106           107           108           109           110 
      1  -0.299513D+00  0.166856D+01 -0.339510D+00  0.238951D+00  0.139156D-01
      2  -0.991830D+00  0.369046D+00 -0.265211D+00  0.645406D+00 -0.670990D+00
      3  -0.324092D+00  0.128467D+01 -0.849177D-01 -0.680066D+01  0.556879D+01
               111           112           113           114           115 
      1   0.131556D+01 -0.293217D+00  0.747056D+00 -0.426109D+01 -0.356902D+00
      2   0.266780D+00 -0.838863D+00  0.966252D+00 -0.348429D+00 -0.123108D+01
      3   0.513649D+00  0.830985D+01 -0.122787D+02 -0.116808D+01  0.944927D+00
               116           117           118           119           120 
      1   0.193511D+01 -0.220054D+00 -0.725075D+00 -0.149007D+01  0.867497D+00
      2   0.290113D+00 -0.770330D-01 -0.133530D+01 -0.299782D-01  0.355787D+01
      3  -0.179966D+01 -0.104468D+00 -0.650960D+00 -0.355359D+01  0.117697D+01
               121           122           123           124           125 
      1  -0.135392D+01 -0.531849D+00 -0.854896D+00  0.980865D+00  0.282109D+01
      2   0.344038D+00 -0.240292D+00 -0.102312D+01  0.174766D+01 -0.635512D+00
      3  -0.233336D+01 -0.832987D+00  0.223834D+01  0.176492D+01  0.236316D+01
               126           127           128           129           130 
      1  -0.367899D+01  0.259846D+01  0.995269D-01  0.308400D+01 -0.220644D+01
      2  -0.154530D+02  0.802927D+01 -0.210004D+01  0.617092D+01 -0.265786D+01
      3  -0.158414D+00  0.214665D+02 -0.127740D+02 -0.162018D+01 -0.200090D+01
               131           132           133           134           135 
      1   0.936795D+01 -0.272446D+00  0.284892D+00  0.484165D+01 -0.107750D+02
      2   0.714992D+01  0.406530D+00 -0.313429D+00  0.292996D+01 -0.168302D+02
      3  -0.179523D+02 -0.811514D+01 -0.887655D+00 -0.810842D+01 -0.468238D+01
               136           137           138           139           140 
      1   0.251282D+01  0.555363D+00 -0.254309D+01  0.795347D+00  0.774654D+00
      2  -0.503450D+01 -0.193727D+01  0.601462D+01 -0.186134D+01 -0.197828D+01
      3   0.493327D+01 -0.400643D+01 -0.104868D+01  0.521181D+00 -0.229123D+01
               141           142           143           144           145 
      1  -0.157672D+01 -0.274494D+01  0.891240D-01  0.117726D+01 -0.129800D+01
      2   0.196385D+01  0.415352D+01  0.191455D+01 -0.267894D+01  0.195979D+01
      3   0.131432D+01 -0.217698D+01  0.302115D+01  0.849142D+00 -0.690791D-01
               146           147           148           149           150 
      1   0.214816D+00 -0.141969D+01  0.397869D+00 -0.148869D+01 -0.168973D+00
      2  -0.225353D+00  0.309267D+01 -0.673608D+00  0.131209D+01 -0.738907D+00
      3  -0.234591D+00  0.153014D+01  0.159644D+01  0.236971D+01 -0.195439D+01
               151           152           153           154           155 
      1  -0.374126D+01  0.262514D+01 -0.903983D+01  0.220719D+01  0.333046D+00
      2   0.319265D+01  0.149551D+01  0.168101D+02  0.337855D+00 -0.154920D+00
      3   0.356705D+01 -0.511187D+01  0.219312D+01  0.365273D+01  0.359384D+00
               156           157           158           159           160 
      1  -0.842738D+00  0.138784D+01  0.378795D+01 -0.664237D+01 -0.315821D+01
      2   0.114224D+01  0.955624D-01 -0.195243D+01  0.202714D+01 -0.874923D+00
      3  -0.251177D+01  0.161968D+01 -0.107589D+01  0.777463D+00 -0.619940D+01
               161           162           163           164           165 
      1  -0.867620D+01  0.145846D+02 -0.132341D+01  0.643485D+00  0.478025D+00
      2   0.384343D+01 -0.521574D+01  0.306230D+00 -0.399407D+00  0.717609D+00
      3  -0.186188D+00 -0.116000D+01 -0.117380D+01  0.931400D-01  0.199313D+01
               166           167           168           169           170 
      1  -0.135440D+01 -0.775357D+01 -0.764254D+01 -0.147230D+01 -0.800080D+01
      2  -0.536298D+00  0.228354D+01  0.167822D+01 -0.773884D+00  0.250510D+01
      3   0.474608D+01 -0.534812D+01 -0.246161D+01  0.433322D+01 -0.407855D+01
               171           172           173           174           175 
      1  -0.669213D+01  0.110082D+01 -0.634976D+00 -0.179014D+01 -0.174996D+00
      2   0.146607D+01  0.249290D+01  0.420194D+00 -0.240878D+01  0.849059D-01
      3  -0.243513D+01 -0.383668D+00  0.160651D+01 -0.178460D+01  0.120051D+01
               176           177           178           179           180 
      1   0.113119D+01 -0.109882D+01  0.357738D+00  0.133849D+01  0.138636D+02
      2   0.169784D+01 -0.426823D+00 -0.253811D+01 -0.307217D+01  0.196842D+02
      3   0.188558D+01 -0.171269D+01 -0.169911D+01 -0.345938D+01  0.362387D+01
               181           182           183           184           185 
      1  -0.276011D+00  0.184311D+00  0.203838D+01  0.319225D+00 -0.759992D+00
      2  -0.423876D+01 -0.113701D-01  0.615441D+01  0.206662D+00 -0.113872D+01
      3  -0.184063D+02 -0.456405D+01  0.105081D+01 -0.195586D+01 -0.301804D+00
               186           187           188           189           190 
      1  -0.490715D+00  0.158680D+01  0.311279D+00  0.298154D+00 -0.114480D+01
      2   0.537721D+00  0.214215D+01 -0.388141D+00  0.315526D+00 -0.136295D+01
      3   0.124390D+01  0.147032D+01  0.198117D+01 -0.109029D+01  0.403573D+01
               191           192           193           194           195 
      1  -0.530836D+00 -0.176255D+01 -0.516275D+00 -0.555083D+01 -0.591181D+01
      2   0.703988D-01 -0.653101D+00 -0.425938D+00 -0.344541D+01 -0.307493D+01
      3   0.491293D+01  0.177240D+01  0.561937D+01  0.237188D+02  0.533701D+01
               196           197           198 
      1  -0.530013D+00 -0.230535D+01 -0.185578D+01
      2  -0.145229D+01 -0.305476D+01 -0.117185D+01
      3   0.233669D+01  0.681613D+01  0.465418D+01
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.140438D+00 -0.250210D+02 -0.152103D+01  0.275997D+02  0.685032D+01
      2  -0.395704D+01  0.173636D+02 -0.698710D+00 -0.292251D+02 -0.127419D+02
      3   0.409748D+01  0.765733D+01  0.221974D+01  0.162541D+01  0.589159D+01
      4  -0.222834D+02  0.571675D+01  0.547767D+01  0.767060D+01 -0.142699D+02
      5   0.163036D+01  0.582060D+01  0.796540D+01  0.303098D+00 -0.318816D+01
      6   0.529401D+01  0.196193D+01  0.103984D+02 -0.345861D+01  0.462913D+00
                 6             7             8             9            10 
      1   0.101899D+01  0.636157D+01  0.655640D+01  0.158647D+01 -0.135461D+02
      2   0.497871D+00 -0.461483D+01 -0.550329D+01 -0.843145D+01  0.638137D+01
      3  -0.151686D+01 -0.174673D+01 -0.105311D+01  0.684498D+01  0.716478D+01
      4  -0.417795D+01  0.478692D+01 -0.213491D+01  0.157480D+02  0.492632D+01
      5   0.166216D+02  0.235946D+02  0.181809D+02  0.229862D+01  0.106179D+02
      6   0.559400D+01  0.101609D+02  0.160110D+02 -0.201525D+01 -0.823132D+00
                11            12            13            14            15 
      1   0.280860D+01  0.753951D+01 -0.134710D+02 -0.250295D+02 -0.241445D+01
      2  -0.416127D+00 -0.383633D+01  0.121614D+02  0.264404D+02  0.395083D+01
      3  -0.239247D+01 -0.370318D+01  0.130961D+01 -0.141083D+01 -0.153638D+01
      4   0.235086D+02 -0.104492D+01 -0.282203D+02  0.892896D+01  0.351782D+01
      5  -0.161873D+01  0.203788D+02 -0.606953D+01  0.282832D+01 -0.372115D+01
      6  -0.887614D+00 -0.196309D+01  0.316420D+01 -0.815040D+00 -0.694599D+01
                16            17            18            19            20 
      1   0.104904D+02 -0.409334D+01  0.138278D+02  0.151178D+02  0.211757D+02
      2  -0.352099D+01  0.269459D+01 -0.199993D+02 -0.135121D+02 -0.150645D+02
      3  -0.696946D+01  0.139875D+01  0.617144D+01 -0.160574D+01 -0.611123D+01
      4  -0.666333D+01 -0.920970D+00 -0.182685D+01  0.127973D+02 -0.137193D+02
      5   0.364330D+02 -0.383523D+01 -0.677727D+01  0.118716D+01 -0.436363D+01
      6  -0.954603D-01  0.515034D+01 -0.175776D+01 -0.285830D+01  0.499955D+01
                21            22            23            24            25 
      1  -0.828146D+00 -0.208838D+02  0.131618D+02  0.719227D+00 -0.216380D+00
      2   0.360291D+00  0.207558D+02 -0.226653D+02 -0.400208D+01  0.207771D+01
      3   0.467855D+00  0.128000D+00  0.950350D+01  0.328285D+01 -0.186133D+01
      4  -0.393700D+01  0.939072D+01  0.389712D+01  0.244001D+01 -0.426231D+01
      5  -0.295889D+01 -0.105839D+01  0.286042D+01 -0.138955D+02  0.118030D+02
      6  -0.702716D+00  0.171260D+01 -0.504074D+01  0.796743D+01 -0.719468D+01
                26            27            28            29            30 
      1  -0.212387D+01 -0.401442D+01 -0.963213D+01 -0.272073D+02 -0.740090D+00
      2  -0.266206D+01 -0.648897D+01  0.812872D+01  0.206246D+02 -0.155825D+01
      3   0.478593D+01  0.105034D+02  0.150341D+01  0.658272D+01  0.229834D+01
      4   0.643089D+01 -0.155466D+02 -0.107060D+02 -0.744848D+01  0.128835D-01
      5  -0.154445D+02 -0.188789D+01 -0.175455D+01  0.507159D+00 -0.133664D+01
      6   0.130592D+02  0.224217D+01  0.723026D-01 -0.369451D+01  0.309037D+01
                31            32            33            34            35 
      1  -0.110688D+02 -0.827497D+01 -0.586686D+00  0.191005D+01  0.747860D+00
      2   0.233550D+00  0.795760D+01  0.296373D+00 -0.282094D+01 -0.551638D+00
      3   0.108352D+02  0.317376D+00  0.290313D+00  0.910886D+00 -0.196223D+00
      4   0.734037D+01 -0.989014D+01 -0.230074D+01 -0.549543D+00  0.138347D+01
      5  -0.260499D+01 -0.233975D+01 -0.845877D+00  0.135767D+01 -0.307544D+01
      6  -0.743760D+01 -0.164422D+01  0.323271D+01  0.217127D+01  0.106358D+02
                36            37            38            39            40 
      1  -0.125793D+02 -0.246081D+02  0.456731D+01 -0.411975D+00 -0.338824D+01
      2   0.246593D+01  0.881425D+01 -0.104686D+01  0.458008D+00  0.574090D+01
      3   0.101134D+02  0.157938D+02 -0.352045D+01 -0.460330D-01 -0.235267D+01
      4  -0.204381D+01 -0.627412D+01  0.696883D+01  0.734474D+00 -0.109042D+02
      5   0.211600D+01 -0.688819D+01 -0.270440D+00  0.118971D+01  0.357758D+00
      6  -0.132079D+01  0.629607D+00 -0.173370D+01 -0.196344D+01  0.524470D+01
                41            42            43            44            45 
      1  -0.468668D+01  0.943364D+00  0.429987D+01 -0.178745D+01 -0.878381D+01
      2   0.127813D+02  0.154362D+01 -0.779343D+00  0.179557D+01 -0.331932D+01
      3  -0.809460D+01 -0.248698D+01 -0.352053D+01 -0.812520D-02  0.121031D+02
      4   0.725633D+01  0.356141D+01 -0.170855D+01  0.407405D+01 -0.139689D+01
      5   0.257703D+01  0.219196D+00  0.386954D+01  0.100047D+01  0.553670D-02
      6   0.847541D+00 -0.694870D+00 -0.138664D+01  0.451565D+01  0.911959D+00
                46            47            48            49            50 
      1   0.797229D+01  0.121348D+02 -0.100041D+01  0.331628D+01  0.832302D+01
      2  -0.548138D+01 -0.110953D+02  0.158837D+01  0.535776D+01 -0.162470D+02
      3  -0.249091D+01 -0.103947D+01 -0.587965D+00 -0.867403D+01  0.792398D+01
      4   0.124086D+02 -0.196750D+02 -0.252652D+01  0.158267D+02  0.124571D+02
      5   0.173405D+00 -0.248349D+01 -0.629897D+01  0.166015D+01  0.580478D+00
      6  -0.420928D+01  0.289948D+01 -0.845542D+01  0.517172D+00 -0.460694D+01
                51            52            53            54            55 
      1   0.180601D+01 -0.666774D+00 -0.298703D+00 -0.162219D+02  0.184570D+02
      2  -0.361515D+01  0.170967D+01 -0.312342D+01  0.355503D+01 -0.564865D+01
      3   0.180914D+01 -0.104290D+01  0.342213D+01  0.126669D+02 -0.128084D+02
      4   0.304048D+00  0.230839D+01  0.420411D+01  0.696811D+01  0.103572D+02
      5   0.238085D+01  0.124678D+01  0.702170D+01  0.521232D+01  0.432121D+01
      6   0.828713D+01 -0.237083D+01  0.170384D+02  0.488592D+01 -0.226897D+00
                56            57            58            59            60 
      1   0.100847D+01 -0.167194D+01  0.504775D+01 -0.845525D+01  0.156160D+01
      2   0.214346D+01 -0.386088D+01 -0.343939D+00  0.447432D+00  0.126295D+01
      3  -0.315192D+01  0.553282D+01 -0.470381D+01  0.800781D+01 -0.282455D+01
      4  -0.123043D+02  0.426360D+00 -0.229446D+02 -0.632296D+01 -0.845579D+01
      5   0.129935D+01 -0.106610D+02  0.223144D+01 -0.833258D+01  0.390210D+01
      6  -0.354541D+01  0.345801D+01 -0.572722D+01  0.322498D+01 -0.250587D+01
                61            62            63            64            65 
      1  -0.120818D+02  0.184569D+01  0.490980D+01 -0.175361D+02 -0.191970D+02
      2  -0.108110D+02  0.387035D+01  0.126263D+02  0.226206D+01  0.104852D+02
      3   0.228927D+02 -0.571604D+01 -0.175361D+02  0.152740D+02  0.871186D+01
      4   0.122627D+01 -0.135341D+02  0.552935D+01 -0.232701D+02 -0.676741D+01
      5  -0.168247D+02  0.350139D+01  0.378481D+02  0.152186D+02  0.562348D+01
      6   0.637530D+01 -0.660631D+00 -0.864163D+01  0.663873D+01  0.311243D+01
                66            67            68            69            70 
      1   0.988838D+01 -0.208333D+02  0.750541D+00  0.201155D+01  0.161577D+02
      2  -0.188481D+01  0.112535D+02  0.208182D+01  0.745299D+00  0.367172D-01
      3  -0.800357D+01  0.957980D+01 -0.283236D+01 -0.275685D+01 -0.161944D+02
      4   0.714717D+01 -0.404843D+01  0.133697D+02  0.742988D+01  0.139618D+02
      5  -0.798717D+01  0.689271D+01  0.620223D+01  0.151882D+01 -0.149182D+02
      6  -0.359347D+01  0.450740D+01  0.606227D+01  0.181969D+01 -0.717374D+01
                71            72            73            74            75 
      1   0.734854D+01 -0.929618D+01 -0.641660D+01  0.106580D+02 -0.449837D+01
      2  -0.187703D+01  0.169006D+02  0.992499D+01 -0.606052D+01  0.473135D+01
      3  -0.547151D+01 -0.760443D+01 -0.350839D+01 -0.459752D+01 -0.232984D+00
      4   0.102363D+02 -0.704358D+01  0.448219D+01  0.520603D+01  0.373131D-01
      5  -0.260524D+01 -0.288366D+02 -0.153885D+01  0.100354D+01 -0.128705D+01
      6   0.355968D+01 -0.109350D+02  0.104520D+01  0.639576D+01 -0.585101D+00
                76            77            78            79            80 
      1   0.230982D+02  0.299928D+02  0.363624D+00 -0.987592D+01 -0.140153D+01
      2  -0.174608D+02 -0.322493D+02 -0.832553D+01  0.635686D+01 -0.983322D+01
      3  -0.563738D+01  0.225653D+01  0.796191D+01  0.351905D+01  0.112348D+02
      4   0.246166D+01 -0.609722D+01  0.702760D-02 -0.117474D+00  0.203087D+01
      5   0.238228D+01  0.690297D+00 -0.674602D+01 -0.162107D+01 -0.995112D+01
      6   0.511482D+01 -0.593768D+01 -0.222807D+02 -0.106427D+02 -0.411353D+02
                81            82            83            84            85 
      1   0.291338D+02  0.257021D+02  0.156999D+02 -0.294146D+00  0.103658D+02
      2  -0.273303D+02 -0.459784D+01  0.125273D+01  0.936086D-01  0.743533D+01
      3  -0.180342D+01 -0.211043D+02 -0.169526D+02  0.200538D+00 -0.178011D+02
      4  -0.755655D+01  0.383521D+02  0.342626D+02 -0.106270D+01  0.374769D+02
      5   0.814789D+01 -0.437520D+00 -0.616735D+00  0.557589D+01  0.722899D+00
      6   0.174064D+02 -0.117511D+01 -0.124016D+01  0.320180D+01 -0.280284D+00
                86            87            88            89            90 
      1   0.471837D+01  0.137248D+00 -0.181839D+01 -0.140245D+01  0.299414D+00
      2   0.174104D+02 -0.323013D+00  0.929318D+00  0.984889D+00  0.107403D+01
      3  -0.221288D+02  0.185765D+00  0.889072D+00  0.417557D+00 -0.137344D+01
      4   0.462086D+02 -0.624923D-01 -0.163308D+01 -0.784734D+00  0.228205D+01
      5   0.799170D+00  0.460679D+01  0.141193D+01  0.684339D+00 -0.394980D+00
      6  -0.564665D+00  0.521091D+01  0.104699D+01  0.144935D+01 -0.170157D+00
                91            92            93            94            95 
      1   0.102452D+03 -0.100415D+02 -0.914063D+01 -0.983602D+01  0.100532D+02
      2  -0.597231D+02  0.546906D+01  0.634767D+01  0.489458D+01 -0.490403D+01
      3  -0.427294D+02  0.457244D+01  0.279296D+01  0.494144D+01 -0.514920D+01
      4  -0.143887D+02  0.969061D+01  0.140437D+01  0.165297D+02 -0.476207D+01
      5  -0.133069D+02  0.143929D+01  0.108158D+02  0.273416D+01 -0.171375D+01
      6   0.246007D+00 -0.686315D+00 -0.680463D+00 -0.121042D+01  0.317252D+00
                96            97            98            99           100 
      1   0.153820D+01 -0.121289D+02  0.173551D+01  0.347767D+01  0.586244D+01
      2  -0.115486D+01  0.728341D+01 -0.881802D+00 -0.202594D+01  0.230647D+01
      3  -0.383342D+00  0.484544D+01 -0.853703D+00 -0.145174D+01 -0.816891D+01
      4  -0.176077D+01  0.306352D+01 -0.141793D+01 -0.102552D+01 -0.179964D+02
      5  -0.156629D+01  0.318534D+01 -0.169738D+00 -0.205008D+01 -0.212853D+01
      6   0.175883D+01 -0.316738D+00  0.681785D+00  0.490394D+00  0.179547D+01
               101           102           103           104           105 
      1  -0.447607D+01 -0.587942D+00  0.167557D+00 -0.144545D+02 -0.154105D+01
      2  -0.422801D+01  0.435903D-01 -0.103497D+02  0.352264D+02  0.237980D+01
      3   0.870409D+01  0.544351D+00  0.101821D+02 -0.207719D+02 -0.838749D+00
      4   0.216297D+02  0.271641D+01  0.251180D+02 -0.473780D+02 -0.461856D+01
      5   0.239041D+01  0.337842D+01  0.229484D+01 -0.353164D+01 -0.444768D+01
      6  -0.217218D+01 -0.231578D+01 -0.253846D+01  0.627918D+01  0.714897D+01
               106           107           108           109           110 
      1  -0.716029D+00 -0.101168D+01 -0.166880D+01 -0.433606D+01  0.810190D+01
      2  -0.598934D+00  0.301019D+01  0.284223D+01  0.657914D+01 -0.100131D+02
      3   0.131496D+01 -0.199852D+01 -0.117343D+01 -0.224308D+01  0.191116D+01
      4   0.401722D+01 -0.582814D+01 -0.223714D+01 -0.334322D+01  0.780844D+01
      5   0.145114D+01 -0.141172D+01 -0.115951D+01  0.363444D+00 -0.324373D-01
      6  -0.163146D+01  0.355758D+01  0.151235D+01  0.120384D+01 -0.223846D+01
               111           112           113           114           115 
      1   0.150600D+01  0.654957D+01 -0.369554D+02 -0.399345D+01  0.995813D+00
      2  -0.996370D+00 -0.847390D+01  0.519091D+02  0.406750D+01 -0.112378D+01
      3  -0.509632D+00  0.192434D+01 -0.149537D+02 -0.740498D-01  0.127963D+00
      4   0.318562D+00  0.599119D+01  0.295309D+01  0.524150D+00  0.362910D+00
      5   0.107141D+01 -0.559706D-01  0.178930D+01  0.358116D+00  0.496515D+00
      6  -0.178555D+01 -0.119723D+01  0.755852D+01  0.735127D+01 -0.524098D+00
               116           117           118           119           120 
      1  -0.339849D+01 -0.180270D+01  0.483360D+01 -0.837699D+00 -0.407688D+01
      2   0.420034D+01  0.239152D+01 -0.830883D+01  0.283986D+00  0.600178D+01
      3  -0.801850D+00 -0.588826D+00  0.347522D+01  0.553713D+00 -0.192490D+01
      4  -0.324757D+00 -0.161461D+01 -0.391990D+01  0.693173D+01  0.172300D+01
      5  -0.621995D+00 -0.626601D+00 -0.112087D+02  0.111999D+01  0.154455D+02
      6   0.319626D+01  0.142761D+01  0.208805D+01 -0.148713D+00 -0.174613D+01
               121           122           123           124           125 
      1  -0.388496D+00 -0.170609D+01 -0.358211D+00 -0.964478D+00 -0.914346D+00
      2  -0.550592D+00 -0.844452D+00  0.200590D+00  0.129340D+02 -0.117730D+01
      3   0.939088D+00  0.255054D+01  0.157621D+00 -0.119696D+02  0.209165D+01
      4   0.972069D+01 -0.281077D+01 -0.433903D+01  0.437347D+01 -0.571595D+01
      5   0.505594D+00 -0.424498D+01 -0.159628D+01  0.232389D+02 -0.378251D+01
      6  -0.163356D+01  0.111868D+01  0.803496D+01 -0.409927D+01  0.529682D+01
               126           127           128           129           130 
      1  -0.135206D+02 -0.630797D+02  0.954028D+01  0.465013D+01 -0.315255D+01
      2  -0.236006D+02  0.360612D+02 -0.136973D+02 -0.484455D+01 -0.446809D+01
      3   0.371213D+02  0.270185D+02  0.415701D+01  0.194415D+00  0.762064D+01
      4  -0.376694D+01  0.145960D+02  0.152486D+02 -0.360281D+01  0.217838D+02
      5  -0.403331D+02  0.509003D+01 -0.152763D+01  0.878875D+01 -0.407390D+01
      6   0.923612D+01 -0.701399D+01  0.247748D+01 -0.578216D+01  0.423061D+01
               131           132           133           134           135 
      1   0.249318D+02  0.553793D+01  0.966628D+01  0.325605D+01  0.166934D+02
      2  -0.280027D+02 -0.118455D+02 -0.170095D+01 -0.132473D+02  0.169519D-01
      3   0.307086D+01  0.630757D+01 -0.796532D+01  0.999126D+01 -0.167104D+02
      4   0.409416D+01  0.131007D+02 -0.973607D+01  0.155281D+02 -0.289984D+01
      5   0.155650D+02  0.448526D+00  0.758169D+01  0.208534D+01 -0.273283D+02
      6  -0.137876D+02 -0.210418D+00 -0.449655D+01 -0.155100D+01  0.184967D+02
               136           137           138           139           140 
      1   0.514162D+02  0.147725D+02 -0.984213D+01  0.116446D+02  0.609814D+01
      2  -0.230119D+02 -0.351642D+01  0.447825D+01 -0.127563D+01  0.276769D+01
      3  -0.284043D+02 -0.112561D+02  0.536388D+01 -0.103690D+02 -0.886584D+01
      4   0.360929D+02  0.208307D+02 -0.710105D+01  0.209402D+02  0.147457D+02
      5  -0.145232D+02 -0.466508D+01  0.110115D+02 -0.447680D+01 -0.528845D+01
      6  -0.606790D+01 -0.301675D+01  0.444031D+01 -0.322418D+01 -0.315704D+01
               141           142           143           144           145 
      1  -0.176764D+01 -0.161395D+02 -0.334134D+01  0.746771D+01  0.747688D+01
      2  -0.593757D+00  0.824807D+01 -0.358785D-01 -0.630921D+01 -0.649808D+01
      3   0.236140D+01  0.789140D+01  0.337722D+01 -0.115850D+01 -0.978795D+00
      4  -0.584503D+01 -0.128337D+02 -0.980361D+01  0.819706D+01  0.547262D+01
      5   0.344943D+01  0.156346D+02  0.587790D+01 -0.698355D+01  0.831624D+01
      6   0.332561D+01  0.708064D+01  0.398762D+01 -0.349385D+01  0.249534D+01
               146           147           148           149           150 
      1   0.362811D+01  0.475077D+01  0.410607D+00 -0.105340D+01 -0.171604D+01
      2  -0.207618D+01 -0.495044D+01  0.137037D+01 -0.130104D+01  0.245835D+01
      3  -0.155193D+01  0.199668D+00 -0.178098D+01  0.235444D+01 -0.742312D+00
      4   0.267578D+01  0.213114D+01  0.407775D+01 -0.995254D+00  0.387857D+01
      5   0.482210D+00  0.959189D+01 -0.146080D+01  0.382080D+01 -0.221491D+01
      6   0.105544D+01  0.177053D+01  0.115564D+01  0.113889D+01  0.490804D+01
               151           152           153           154           155 
      1   0.784744D+01 -0.220209D+01 -0.152248D+01  0.339531D+00  0.528403D+00
      2  -0.114356D+02  0.172952D+01 -0.193607D+02 -0.126117D+01 -0.334716D+00
      3   0.358815D+01  0.472567D+00  0.208832D+02  0.921640D+00 -0.193687D+00
      4   0.458195D+01  0.730618D+01  0.695747D+01  0.328196D+01  0.699270D+01
      5   0.191556D+02  0.361350D+01  0.358758D+02 -0.229848D+01 -0.366050D+01
      6   0.668885D+01  0.478194D+01  0.159291D+02 -0.647944D+01 -0.205213D+01
               156           157           158           159           160 
      1  -0.643314D+00 -0.495418D+01 -0.238671D+02  0.117615D+02  0.424682D+01
      2  -0.148954D+00  0.591814D+01  0.273347D+02 -0.109279D+02 -0.297594D+01
      3   0.792269D+00 -0.963963D+00 -0.346758D+01 -0.833661D+00 -0.127088D+01
      4  -0.553681D+01  0.521936D+01  0.849247D+01 -0.432215D+01 -0.909743D+01
      5   0.641891D+01 -0.240039D+01 -0.494285D+01  0.445163D+01  0.693074D+01
      6   0.196769D+01 -0.438372D+01 -0.186856D+02  0.182694D+02  0.930149D+01
               161           162           163           164           165 
      1   0.227147D+02 -0.264128D+02 -0.505376D+00  0.438847D+01  0.236222D+01
      2  -0.179526D+02  0.126105D+02  0.270152D+01 -0.503136D+01 -0.191534D+01
      3  -0.476212D+01  0.138023D+02 -0.219614D+01  0.642889D+00 -0.446873D+00
      4  -0.905972D+01  0.741964D+01  0.120364D+01  0.802150D+01  0.382757D+01
      5   0.975793D+01 -0.117320D+02  0.104036D+01  0.182076D+01  0.272196D+01
      6   0.332683D+02 -0.356740D+02  0.487409D+01 -0.142944D+01 -0.767055D+00
               166           167           168           169           170 
      1  -0.282949D+01 -0.366422D+02 -0.113067D+02  0.490024D+00 -0.198113D+02
      2   0.447468D+01  0.530987D+02  0.164440D+02  0.127932D+01  0.263081D+02
      3  -0.164519D+01 -0.164565D+02 -0.513727D+01 -0.176935D+01 -0.649681D+01
      4   0.687674D+01  0.105424D+02  0.312318D+01  0.543539D+01  0.570924D+01
      5   0.159613D+01  0.372382D+01  0.332656D+01  0.345141D+01  0.540044D+01
      6   0.173349D+01  0.221798D+02  0.163594D+02  0.395664D+01  0.259190D+02
               171           172           173           174           175 
      1  -0.164565D+02  0.385568D+01 -0.249743D+01  0.588754D+01  0.110712D+01
      2   0.153283D+02 -0.419660D+01  0.304405D+01 -0.107964D+01 -0.793561D+00
      3   0.112819D+01  0.340914D+00 -0.546621D+00 -0.480789D+01 -0.313559D+00
      4   0.434559D+01 -0.381121D+00 -0.215575D+01 -0.187246D+01 -0.712541D+00
      5   0.236937D+01  0.220464D+01  0.143884D+00 -0.439473D+00  0.584347D+00
      6   0.151108D+02 -0.183418D+01 -0.160219D+01  0.338041D+01  0.850753D-02
               176           177           178           179           180 
      1  -0.620875D+01  0.233426D+01  0.622129D+01  0.376759D+01 -0.183224D+02
      2   0.436740D+01 -0.252155D+01 -0.358478D+01 -0.262105D+01 -0.938869D+01
      3   0.184136D+01  0.187286D+00 -0.263650D+01 -0.114654D+01  0.277111D+02
      4  -0.144613D+01  0.264132D+01 -0.645614D+01  0.728789D+01 -0.295116D+01
      5   0.222533D+01 -0.461720D+00  0.762243D+01 -0.626078D+01  0.334927D+02
      6  -0.234116D+01  0.620386D+01 -0.191671D+01  0.925383D+01 -0.262083D+02
               181           182           183           184           185 
      1   0.900344D+02 -0.867830D+01 -0.352701D+01  0.572915D+01  0.452241D+01
      2  -0.463786D+02  0.105436D+01  0.159964D+01 -0.598016D+01  0.461471D+00
      3  -0.436558D+02  0.762394D+01  0.192737D+01  0.251006D+00 -0.498388D+01
      4  -0.375454D+02  0.160768D+02  0.828643D+00  0.879821D+01 -0.373766D+01
      5   0.206157D+01 -0.524659D+00  0.105359D+02  0.505936D+00 -0.174721D+01
      6   0.205844D+01  0.877336D+00 -0.407737D+01  0.361694D+00  0.127880D+01
               186           187           188           189           190 
      1  -0.909255D+00 -0.750188D+01 -0.358554D+00  0.603899D+01  0.272880D+01
      2   0.145128D+01  0.397056D+01  0.208536D+01 -0.513142D+01  0.119129D+01
      3  -0.542029D+00  0.353132D+01 -0.172680D+01 -0.907570D+00 -0.392009D+01
      4  -0.186822D+01  0.397813D+01 -0.384631D+01 -0.300894D+01 -0.200689D+01
      5   0.944611D+00  0.115904D+02 -0.176939D+01 -0.337421D+00 -0.162528D+01
      6   0.754370D+00 -0.349503D+01  0.191098D+01 -0.681880D+00  0.224715D+01
               191           192           193           194           195 
      1  -0.858200D+01 -0.244753D+01 -0.546766D+01 -0.283386D+02 -0.613062D+01
      2   0.962219D+01  0.239520D+01  0.179976D+01  0.492115D+02  0.999202D+01
      3  -0.104019D+01  0.523314D-01  0.366790D+01 -0.208729D+02 -0.386140D+01
      4  -0.940845D-01  0.138459D+01  0.894396D+01 -0.333799D+02 -0.626256D+01
      5  -0.401458D+00 -0.132182D+01 -0.570576D+00 -0.833281D+01 -0.673287D+01
      6   0.668163D+00  0.271024D+01 -0.144791D+00  0.759782D+01  0.901023D+01
               196           197           198 
      1  -0.425384D+01 -0.681779D+01 -0.789909D+01
      2   0.146482D+01  0.117971D+02  0.650868D+01
      3   0.278902D+01 -0.497929D+01  0.139040D+01
      4   0.496157D+01 -0.108200D+02 -0.452887D+01
      5   0.645182D+00 -0.634056D+01 -0.240420D+01
      6   0.417517D+00  0.947845D+01  0.473511D+01

 ----------------------------------------------------------------------

 Electric dipole moment (input orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.248154D+00      0.630743D+00      0.210393D+01
   x          0.228478D+00      0.580733D+00      0.193712D+01
   y          0.849445D-01      0.215907D+00      0.720189D+00
   z         -0.465018D-01     -0.118196D+00     -0.394258D+00

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.111471D+03      0.165183D+02      0.183791D+02
   aniso      0.570471D+02      0.845351D+01      0.940580D+01
   xx         0.137958D+03      0.204432D+02      0.227462D+02
   yx         0.163919D+01      0.242903D+00      0.270266D+00
   yy         0.121490D+03      0.180029D+02      0.200309D+02
   zx        -0.354524D+01     -0.525350D+00     -0.584531D+00
   zy         0.151232D+01      0.224103D+00      0.249348D+00
   zz         0.749665D+02      0.111089D+02      0.123603D+02

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  532.0nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.119780D+03      0.177496D+02      0.197491D+02
   aniso      0.583527D+02      0.864698D+01      0.962107D+01
   xx         0.147336D+03      0.218330D+02      0.242925D+02
   yx         0.185567D+01      0.274983D+00      0.305959D+00
   yy         0.129405D+03      0.191758D+02      0.213360D+02
   zx        -0.348524D+01     -0.516459D+00     -0.574638D+00
   zy         0.148588D+01      0.220184D+00      0.244988D+00
   zz         0.825990D+02      0.122399D+02      0.136187D+02

 ----------------------------------------------------------------------

 Dipole orientation:
     6         -0.56469655          1.00365449         -4.55743152
     6         -1.20986827         -1.54511696         -4.60129481
     6         -1.30345256         -2.93267351         -2.36616220
     6         -0.73934845         -1.74384953         -0.09972884
     6         -0.09110474          0.81339270         -0.05371423
     6         -0.00390573          2.19672292         -2.27856556
     6          0.40639081          1.68329970          2.62667135
     6          0.80348043         -0.84403721          4.03702730
     6         -0.73210609         -2.81674549          2.54175414
     1         -0.48852925          2.06263104         -6.30614058
     1         -1.63120726         -2.45621651         -6.38386003
     1         -1.79798374         -4.91928057         -2.40719885
     1          0.50546046          4.17909947         -2.25955092
     1         -1.32533153          2.57546650          3.34296304
     6          2.57573924          3.55181208          2.93253577
     1          0.27173336         -0.73516801          6.02457714
     1          2.80931069         -1.33543593          3.95290119
     1         -2.66869843         -2.94366091          3.26328352
     1          0.07298243         -4.71211499          2.64459003
     1          4.32875066          2.75645476          2.18752716
     1          2.87317206          4.01252755          4.92196496
     1          2.20357921          5.31694588          1.93240411

 Electric dipole moment (dipole orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.248154D+00      0.630743D+00      0.210393D+01
   x          0.000000D+00      0.000000D+00      0.000000D+00
   y          0.000000D+00      0.000000D+00      0.000000D+00
   z          0.248154D+00      0.630743D+00      0.210393D+01

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.111471D+03      0.165183D+02      0.183791D+02
   aniso      0.570471D+02      0.845351D+01      0.940580D+01
   xx         0.805435D+02      0.119353D+02      0.132798D+02
   yx         0.137380D+02      0.203576D+01      0.226508D+01
   yy         0.117992D+03      0.174846D+02      0.194542D+02
   zx         0.986082D+01      0.146122D+01      0.162583D+01
   zy         0.120081D+01      0.177942D+00      0.197987D+00
   zz         0.135879D+03      0.201351D+02      0.224034D+02

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  532.0nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.119780D+03      0.177496D+02      0.197491D+02
   aniso      0.583527D+02      0.864698D+01      0.962107D+01
   xx         0.883505D+02      0.130922D+02      0.145670D+02
   yx         0.138955D+02      0.205910D+01      0.229106D+01
   yy         0.125846D+03      0.186485D+02      0.207492D+02
   zx         0.103014D+02      0.152650D+01      0.169847D+01
   zy         0.135703D+01      0.201092D+00      0.223745D+00
   zz         0.145144D+03      0.215081D+02      0.239310D+02

 ----------------------------------------------------------------------
 1\1\GINC-CPN-F16-39\Freq\RM11\Gen\C10H12\PIERPA\08-Jul-2021\0\\#P M11/
 Gen Integral=UltraFineGrid SCF=(NoSymm,MaxCyc=120) Polar=ROA Guess=Rea
 d Geom=Check CPHF=RdFreq\\ROA calculations.\\0,1\C,-2.164986,-1.22492,
 -0.005005\C,-2.64202,0.073409,0.14669\C,-1.762079,1.153232,0.130794\C,
 -0.405452,0.917524,-0.034454\C,0.074285,-0.384887,-0.1864\C,-0.802207,
 -1.459935,-0.173869\C,1.57772,-0.384146,-0.367381\C,1.970002,1.020984,
 0.144037\C,0.731931,1.906712,-0.098518\H,-2.85672,-2.057467,0.013689\H
 ,-3.702276,0.24425,0.283207\H,-2.135971,2.162786,0.253773\H,-0.437393,
 -2.473544,-0.28667\H,1.78987,-0.436688,-1.443748\C,2.317593,-1.524644,
 0.320775\H,2.87317,1.403772,-0.331853\H,2.163642,0.958387,1.218672\H,0
 .772481,2.369953,-1.090624\H,0.637692,2.716269,0.626868\H,2.108272,-1.
 526468,1.392826\H,3.39662,-1.425796,0.184958\H,2.021897,-2.495429,-0.0
 8111\\Version=ES64L-G16RevA.03\State=1-A\HF=-388.4843583\RMSD=4.061e-0
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 GOOD SENSE ABOUT TRIVIALITIES IS BETTER THAN NONSENSE
 ABOUT THINGS THAT MATTER

                                       -- MAX BEERBOHM
 Job cpu time:       0 days 11 hours 46 minutes  7.1 seconds.
 Elapsed time:       0 days  0 hours 44 minutes 12.3 seconds.
 File lengths (MBytes):  RWF=    368 Int=      0 D2E=      0 Chk=     12 Scr=      2
 Normal termination of Gaussian 16 at Thu Jul  8 21:25:43 2021.
